data_1pd7_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 1pd7 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.435 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 122.169 0.985 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.421 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.411 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.404 ' HB2' HG22 ' A' ' 58' ' ' VAL . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.404 HG22 ' HB2' ' A' ' 38' ' ' TYR 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t . . . . . 0 N--CA 1.43 -1.447 0 CA-C-O 122.791 1.281 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HB3' HG21 ' A' ' 27' ' ' ILE . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 . . . . . 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . 0.446 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 115.99 1.848 . . . . 0.0 115.99 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.436 HG22 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB2' HD12 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.43 -1.431 0 CA-C-O 122.3 1.048 . . . . 0.0 109.84 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 27' ' ' ILE . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.435 HD12 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.43 -1.446 0 CA-C-O 122.785 1.279 . . . . 0.0 108.04 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.409 ' HA ' HG12 ' A' ' 11' ' ' ILE . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.447 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HB2' HD23 ' B' ' 206' ' ' LEU . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.873 0.844 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.731 0.777 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . 0.42 HG22 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.428 HD23 ' HB2' ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.431 -1.418 0 CA-C-O 122.374 1.083 . . . . 0.0 113.514 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.332 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.531 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t . . . . . 0 N--CA 1.429 -1.485 0 CA-C-O 121.753 0.787 . . . . 0.0 112.848 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.417 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.429 -1.487 0 CA-C-O 121.217 0.532 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 . . . . . 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-O 121.631 0.729 . . . . 0.0 112.856 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 N--CA 1.43 -1.449 0 CA-C-O 123.027 1.394 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 27' ' ' ILE . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.434 HG21 HG22 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.43 -1.473 0 CA-C-O 122.135 0.969 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.434 HG22 HG21 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 N--CA 1.429 -1.49 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 . . . . . 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.481 1.134 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.431 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.456 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 121.8 0.81 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.456 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 N--CA 1.431 -1.384 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 . . . . . 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.431 -1.421 0 CA-C-O 122.278 1.037 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 11' ' ' ILE . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.401 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.066 0.46 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 . . . . . 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t . . . . . 0 N--CA 1.43 -1.43 0 CA-C-O 123.201 1.476 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.406 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 N--CA 1.429 -1.494 0 CA-C-O 122.06 0.934 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB3' HG23 ' A' ' 27' ' ' ILE . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 . . . . . 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.439 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.647 1.213 . . . . 0.0 109.02 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.431 -1.408 0 CA-C-O 121.138 0.494 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 . . . . . 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t . . . . . 0 N--CA 1.429 -1.491 0 CA-C-O 123.448 1.594 . . . . 0.0 111.549 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.4 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.426 HG22 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . 0.414 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB2' HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 71.6 m-70 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.431 -1.424 0 CA-C-O 122.726 1.251 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HB3' HG22 ' A' ' 27' ' ' ILE . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 . . . . . 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.431 -1.425 0 CA-C-O 122.641 1.21 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.411 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.421 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.415 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.429 -1.513 0 CA-C-O 121.025 0.441 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 . . . . . 0 N--CA 1.431 -1.418 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 . . . . . 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t . . . . . 0 N--CA 1.43 -1.458 0 CA-C-O 122.342 1.067 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? . . . . . 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.43 -1.45 0 CA-C-O 122.297 1.046 . . . . 0.0 109.164 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.525 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 27' ' ' ILE . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 . . . . . 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 123.198 1.475 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HZ1' ' CD ' ' A' ' 75' ' ' GLU . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.431 -1.409 0 CA-C-O 122.187 0.994 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 27' ' ' ILE . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.428 ' CD ' ' HZ1' ' A' ' 16' ' ' LYS . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.59 1.186 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 123.09 1.424 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.422 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HB2' HD23 ' B' ' 206' ' ' LEU . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 121.936 0.874 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 . . . . . 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.275 1.512 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.426 ' HB2' HD22 ' B' ' 206' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.078 0.466 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' H ' HD11 ' A' ' 65' ' ' LEU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.913 1.339 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.426 HD22 ' HB2' ' A' ' 35' ' ' LEU . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t . . . . . 0 N--CA 1.429 -1.489 0 CA-C-O 122.71 1.243 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.435 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.461 HG21 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB2' HD22 ' B' ' 206' ' ' LEU . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? . . . . . 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.461 ' HB3' HG21 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 . . . . . 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.429 -1.5 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? . . . . . 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.057 1.408 . . . . 0.0 112.633 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 . . . . . 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 . . . . . 0 N--CA 1.431 -1.396 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 . . . . . 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.429 -1.51 0 CA-C-O 122.624 1.202 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.432 -1.373 0 CA-C-O 122.517 1.151 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.407 HD13 ' H ' ' A' ' 65' ' ' LEU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.434 HD13 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.431 -1.42 0 CA-C-O 122.055 0.931 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.453 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 206' ' ' LEU . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.062 0.458 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 . . . . . 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.462 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.414 HD21 ' HB2' ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 . . . . . 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 122.977 1.37 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.405 ' O ' HG12 ' A' ' 11' ' ' ILE . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.418 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.418 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 121.638 0.732 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.19 0.995 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' HG12 ' A' ' 11' ' ' ILE . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.436 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.452 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HB3' HG23 ' A' ' 27' ' ' ILE . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 . . . . . 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 . . . . . 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 122.982 1.372 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.422 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.408 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? . . . . . 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.43 -1.444 0 CA-C-O 121.474 0.654 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.408 ' HB3' HG21 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 123.172 1.463 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.428 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.428 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD22 ' B' ' 206' ' ' LEU . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.882 0.849 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.539 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 . . . . . 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 121.697 0.76 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 . . . . . 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t . . . . . 0 N--CA 1.431 -1.399 0 CA-C-O 122.582 1.182 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.446 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.415 HG22 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.424 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HB3' HG21 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 . . . . . 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.43 -1.47 0 CA-C-O 121.845 0.831 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? . . . . . 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 122.206 1.003 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.1 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t . . . . . 0 N--CA 1.43 -1.442 0 CA-C-O 122.616 1.198 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.446 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.4 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.429 -1.49 0 CA-C-O 121.152 0.501 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 N--CA 1.431 -1.406 0 CA-C-O 120.881 0.372 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 . . . . . 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.43 -1.469 0 CA-C-O 122.703 1.239 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.319 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m . . . . . 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 . . . . . 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 52.3 mp0 . . . . . 0 CA--C 1.49 -1.346 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.265 19.6 m 83.1 123.68 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.293 2.237 . . . . 0.0 114.466 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -84.76 113.53 21.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.313 1.445 . . . . 0.0 111.96 -177.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.0 m -142.42 26.11 1.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 122.75 1.262 . . . . 0.0 111.666 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.86 -47.41 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 176.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.435 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.421 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -19.08 65.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -43.74 -40.45 4.3 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 129.507 3.123 . . . . 0.0 116.817 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -40.01 -50.15 2.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.832 2.853 . . . . 0.0 117.393 177.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -58.38 -32.14 68.3 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.999 1.72 . . . . 0.0 115.524 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.5 mt -103.34 -9.38 19.52 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.594 -1.317 . . . . 0.0 112.14 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -80.84 -39.93 25.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.96 1.304 . . . . 0.0 111.666 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.3 p -81.74 166.54 19.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.251 1.02 . . . . 0.0 111.828 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -110.7 56.21 0.64 Allowed 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.211 -1.556 . . . . 0.0 107.201 165.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 169.47 -99.6 0.15 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.774 -1.204 . . . . 0.0 113.315 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -86.99 153.66 54.68 Favored Pre-proline 0 N--CA 1.43 -1.434 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -165.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.0 167.72 26.43 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 122.904 2.403 . . . . 0.0 113.651 168.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.39 -161.36 1.16 Allowed 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.835 -1.166 . . . . 0.0 109.944 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -102.92 -12.68 17.33 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 120.138 -1.601 . . . . 0.0 113.185 177.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.3 -89.63 1.63 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.981 -1.074 . . . . 0.0 110.475 -173.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.3 -147.65 0.22 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.31 1.444 . . . . 0.0 108.412 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p -91.25 131.25 36.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.454 -1.404 . . . . 0.0 110.419 167.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -71.85 -35.29 69.8 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -88.82 -2.94 58.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.643 1.577 . . . . 0.0 110.159 -174.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 74.3 mt -99.56 106.88 42.52 Favored Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.578 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -77.36 92.11 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.978 0 C-N-CA 122.273 1.982 . . . . 0.0 112.506 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -100.9 -87.28 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.513 -0.742 . . . . 0.0 112.655 174.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.53 -39.22 3.03 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.282 -0.886 . . . . 0.0 109.617 -165.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.7 tttp 72.27 65.81 0.13 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.824 2.45 . . . . 0.0 112.139 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--O 1.26 1.626 0 C-N-CA 124.632 1.173 . . . . 0.0 110.254 178.504 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.489 -1.375 0 CA-C-O 122.03 0.919 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.0 mtm180 -117.5 43.16 2.42 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.023 -1.673 . . . . 0.0 111.516 -173.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 43.1 mtp -84.76 84.39 7.7 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.94 -1.725 . . . . 0.0 111.669 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -122.96 173.32 7.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 172.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.421 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -60.72 -39.75 89.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -62.71 -40.0 95.79 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.524 -1.36 . . . . 0.0 112.585 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.92 -28.48 62.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.254 1.422 . . . . 0.0 113.881 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -65.08 -42.2 94.34 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 126.425 1.89 . . . . 0.0 111.769 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.08 -25.12 65.18 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.77 -46.22 63.33 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.884 -1.135 . . . . 0.0 114.052 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 125.853 1.661 . . . . 0.0 115.03 -179.683 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 . . . . . 0 CA--C 1.489 -1.378 0 CA-C-O 121.195 0.521 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -147.24 125.34 12.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.525 -1.359 . . . . 0.0 109.198 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -125.71 -42.82 1.9 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 123.776 0.831 . . . . 0.0 112.27 -173.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.4 m -76.63 33.2 0.13 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t -49.09 -53.48 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 129.338 3.055 . . . . 0.0 113.847 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.411 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.404 ' HB2' HG22 ' A' ' 58' ' ' VAL . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -17.19 64.09 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -46.59 -29.91 2.04 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 117.321 2.341 . . . . 0.0 117.321 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -45.55 -47.31 14.39 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 127.829 2.452 . . . . 0.0 115.035 167.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.65 18.54 10.75 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.605 1.962 . . . . 0.0 115.524 165.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.8 mt 70.67 35.67 1.79 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.618 2.367 . . . . 0.0 113.078 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -68.53 -33.44 74.11 Favored 'General case' 0 CA--C 1.49 -1.365 0 C-N-CA 125.755 1.622 . . . . 0.0 112.381 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.31 169.29 18.05 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 121.497 -0.752 . . . . 0.0 109.55 164.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -116.2 129.53 56.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.624 1.569 . . . . 0.0 107.601 177.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 147.42 -81.05 0.21 Allowed Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.727 -1.233 . . . . 0.0 113.925 173.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -116.24 157.12 46.13 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 125.105 1.362 . . . . 0.0 111.804 -171.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.37 116.31 4.3 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 C-N-CA 123.106 2.537 . . . . 0.0 112.442 168.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -99.95 -77.25 0.53 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.883 1.273 . . . . 0.0 108.038 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.02 -29.4 49.45 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 121.169 -0.957 . . . . 0.0 110.529 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.05 3.48 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 125.696 1.617 . . . . 0.0 114.251 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.329 0.0 OUTLIER 20.66 -132.02 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.468 1 C-N-CA 132.516 4.326 . . . . 0.0 118.781 165.763 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p -97.6 137.06 37.1 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 163.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.425 ' CD ' ' HZ1' ' A' ' 84' ' ' LYS . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.404 HG22 ' HB2' ' A' ' 38' ' ' TYR 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -42.24 -45.12 4.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -97.1 -52.19 3.94 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.0 0.92 . . . . 0.0 109.819 168.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.386 18.0 mt -42.35 -82.14 0.01 OUTLIER Pre-proline 0 N--CA 1.429 -1.477 0 N-CA-C 120.283 3.438 . . . . 0.0 120.283 -149.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -73.23 101.61 1.37 Allowed 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 126.992 3.533 . . . . 0.0 113.675 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.72 -57.03 6.23 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.836 1.655 . . . . 0.0 112.532 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -165.09 91.5 0.54 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.425 ' HZ1' ' CD ' ' A' ' 55' ' ' GLU . 11.0 tppt? -100.71 -58.58 1.87 Allowed 'General case' 0 N--CA 1.428 -1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 112.592 -163.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.0 mtm105 . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.577 1.151 . . . . 0.0 111.572 177.785 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.8 m . . . . . 0 CA--C 1.489 -1.369 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 52.0 mtm-85 72.42 156.49 0.17 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.707 1.603 . . . . 0.0 112.955 -170.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.0 mtt -77.04 166.13 23.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.17 -1.582 . . . . 0.0 112.854 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -173.71 -178.71 1.65 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 -57.13 -25.6 59.12 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -64.36 -36.15 83.21 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.56 1.144 . . . . 0.0 113.617 171.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -73.26 -50.52 21.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.072 -1.642 . . . . 0.0 110.273 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.86 -20.12 65.57 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 127.584 2.354 . . . . 0.0 115.99 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.07 -19.51 5.0 Favored 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 127.818 2.447 . . . . 0.0 115.894 170.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -59.86 -35.09 74.06 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 172.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.2 p80 . . . . . 0 C--O 1.26 1.625 0 C-N-CA 124.153 0.981 . . . . 0.0 111.99 -178.855 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 120.568 0.223 . . . . 0.0 111.516 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.0 p -140.63 144.18 35.61 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.429 -1.419 . . . . 0.0 108.797 160.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -120.04 -69.09 0.86 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.451 1.1 . . . . 0.0 108.088 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.1 m 68.01 35.57 3.67 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 166.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.4 -44.41 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.347 1.859 . . . . 0.0 111.463 175.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.35 -19.64 49.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -59.04 -36.42 74.97 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 128.698 2.799 . . . . 0.0 115.998 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.61 -32.77 41.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.125 0.964 . . . . 0.0 111.879 176.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -86.54 -51.82 5.94 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.886 1.274 . . . . 0.0 113.724 -168.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.26 74.2 mt 53.23 -139.69 1.0 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.28 2.232 . . . . 0.0 116.222 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -135.63 52.83 1.99 Allowed 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.124 -1.61 . . . . 0.0 110.246 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.4 t -92.5 158.41 16.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.538 -1.351 . . . . 0.0 110.847 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 120.51 42.66 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.7 -1.25 . . . . 0.0 111.108 -172.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.21 -107.57 0.33 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.079 -1.013 . . . . 0.0 113.427 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.9 ptm85 -72.02 159.3 85.83 Favored Pre-proline 0 N--CA 1.429 -1.497 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -168.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 109.12 2.81 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.502 2.135 . . . . 0.0 112.396 167.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -107.01 154.47 21.07 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.3 ptt-85 -154.12 109.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.799 1.285 . . . . 0.0 108.148 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.24 117.28 8.31 Favored Glycine 0 N--CA 1.432 -1.615 0 O-C-N 120.746 -1.221 . . . . 0.0 113.35 172.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.288 24.6 ptt? 44.73 -134.51 0.68 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.862 2.465 . . . . 0.0 117.354 162.455 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t -116.06 135.96 53.46 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 158.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HB3' HG21 ' A' ' 27' ' ' ILE . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -66.86 -19.68 65.78 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -95.48 -46.02 6.85 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.036 -1.04 . . . . 0.0 110.739 162.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.4 mt -82.86 162.34 55.42 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -158.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -74.99 136.4 20.37 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 122.617 1.97 . . . . 0.0 113.407 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -125.51 83.51 2.17 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.13 1.443 . . . . 0.0 109.532 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.39 46.11 1.72 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.42 1.488 . . . . 0.0 107.14 -173.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -90.13 -45.36 9.18 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.091 -161.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--O 1.26 1.622 0 C-N-CA 124.242 1.017 . . . . 0.0 111.859 177.298 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 25.2 m . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -161.64 -177.4 5.88 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.283 -0.885 . . . . 0.0 110.676 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.1 ptp -77.22 66.46 3.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.27 -1.519 . . . . 0.0 114.75 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.04 145.4 55.96 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.644 -1.91 . . . . 0.0 111.007 173.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . 0.446 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER -64.45 -25.23 67.92 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.23 -40.07 64.98 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.352 -1.467 . . . . 0.0 111.812 171.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -63.71 -47.46 81.04 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.695 1.198 . . . . 0.0 113.514 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -53.92 -42.77 69.14 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 127.311 2.245 . . . . 0.0 116.484 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.58 -19.67 58.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.29 -17.62 56.36 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 20.7 m170 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -178.115 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 mp0 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m 75.74 177.36 0.2 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.133 1.773 . . . . 0.0 112.955 174.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -117.53 129.67 55.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.075 -1.016 . . . . 0.0 111.974 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.3 m 68.04 37.56 2.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 152.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -50.41 -60.57 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 127.869 2.468 . . . . 0.0 115.99 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.436 HG22 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.435 ' HB2' HD12 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -16.02 63.28 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -40.38 -33.11 0.23 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 129.495 3.118 . . . . 0.0 118.712 174.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -58.82 -19.46 41.59 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 171.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -118.34 -55.67 2.21 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.74 1.616 . . . . 0.0 112.652 176.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.2 mt 63.68 -75.42 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 127.097 2.159 . . . . 0.0 116.154 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -146.52 12.65 1.18 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.72 1.208 . . . . 0.0 109.24 175.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -130.58 -168.35 1.97 Allowed 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.853 -1.779 . . . . 0.0 109.711 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -76.62 163.68 26.63 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.126 1.371 . . . . 0.0 112.171 -175.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -80.16 101.99 2.01 Favored Glycine 0 N--CA 1.43 -1.753 0 O-C-N 120.427 -1.421 . . . . 0.0 113.479 -171.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -75.02 155.46 86.48 Favored Pre-proline 0 N--CA 1.429 -1.488 0 C-N-CA 124.228 1.011 . . . . 0.0 110.979 175.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -70.44 79.67 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.977 0 C-N-CA 122.167 1.911 . . . . 0.0 113.417 160.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -93.05 -132.31 0.14 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.566 1.946 . . . . 0.0 109.421 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.04 -109.7 0.31 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.157 -1.589 . . . . 0.0 108.6 166.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.63 124.91 2.36 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.197 -1.564 . . . . 0.0 109.619 -168.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -156.15 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 126.911 2.084 . . . . 0.0 113.435 -178.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.9 m -106.23 148.76 27.55 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.906 -1.121 . . . . 0.0 109.84 -177.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.436 ' HB3' HG22 ' A' ' 27' ' ' ILE . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -55.08 -45.88 75.43 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -85.84 -50.91 6.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.654 1.182 . . . . 0.0 111.153 167.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.0 mt -76.28 158.99 81.04 Favored Pre-proline 0 N--CA 1.429 -1.502 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -158.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -69.01 152.78 73.16 Favored 'Trans proline' 0 C--N 1.3 -2.026 0 C-N-CA 122.44 2.093 . . . . 0.0 112.919 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -78.5 -52.85 7.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.965 0.888 . . . . 0.0 109.67 165.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.1 -78.82 0.11 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -150.14 63.33 0.97 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.487 1.613 . . . . 0.0 109.667 167.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.155 1.782 . . . . 0.0 111.097 167.788 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 CA--C 1.491 -1.321 0 CA-C-O 123.581 1.657 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -114.27 62.8 0.66 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.152 -2.218 . . . . 0.0 109.395 -178.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.96 65.7 6.2 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.661 1.584 . . . . 0.0 109.944 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -72.29 162.45 29.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 -172.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.435 HD12 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -65.64 -39.47 91.45 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -60.02 -52.08 66.9 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.469 -1.394 . . . . 0.0 112.558 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -60.6 -38.17 83.82 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -69.01 -49.12 60.57 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.589 1.555 . . . . 0.0 113.597 175.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.02 -30.21 69.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.969 1.308 . . . . 0.0 113.661 -177.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -57.39 -52.33 65.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 121.149 -0.969 . . . . 0.0 113.388 171.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 C--O 1.26 1.607 0 C-N-CA 126.471 1.908 . . . . 0.0 115.504 169.791 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 120.97 0.414 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.271 1.0 OUTLIER 77.49 -173.25 0.08 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.212 2.205 . . . . 0.0 111.302 177.743 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.33 -82.98 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.262 -1.524 . . . . 0.0 113.821 -177.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.26 4.1 m 75.11 88.22 0.09 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.421 2.288 . . . . 0.0 109.686 -165.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t -73.33 -49.14 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 126.441 1.896 . . . . 0.0 108.04 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.409 ' HA ' HG12 ' A' ' 11' ' ' ILE . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.409 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.447 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.428 ' HB2' HD23 ' B' ' 206' ' ' LEU . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.83 -17.21 62.9 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -51.77 -35.68 44.66 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 126.833 2.053 . . . . 0.0 115.451 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -62.54 -41.02 98.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.429 -1.419 . . . . 0.0 114.177 177.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 57.25 34.27 24.53 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.083 2.153 . . . . 0.0 115.496 164.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.8 mt 66.02 13.96 9.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.246 2.618 . . . . 0.0 115.565 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -91.28 61.68 4.52 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.02 -1.675 . . . . 0.0 111.383 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.8 m -80.4 96.71 6.79 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.703 -1.248 . . . . 0.0 112.692 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -95.0 -44.84 7.51 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.025 1.33 . . . . 0.0 110.944 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -133.43 -115.56 1.62 Allowed Glycine 0 N--CA 1.43 -1.718 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -100.27 161.0 25.54 Favored Pre-proline 0 N--CA 1.429 -1.513 0 O-C-N 121.696 -0.885 . . . . 0.0 111.17 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -72.66 157.64 51.94 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.251 1.967 . . . . 0.0 113.88 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -122.84 -86.03 0.65 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.92 1.288 . . . . 0.0 109.107 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.33 -55.88 3.93 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.712 -1.243 . . . . 0.0 110.992 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.47 107.57 2.19 Favored Glycine 0 N--CA 1.429 -1.768 0 CA-C-O 121.93 0.739 . . . . 0.0 114.325 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.435 ' HG2' ' H ' ' A' ' 54' ' ' SER . 0.3 OUTLIER -92.28 -123.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.487 2.315 . . . . 0.0 114.011 -172.44 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.435 ' H ' ' HG2' ' A' ' 53' ' ' MET . 15.8 m -110.1 158.61 18.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.841 1.656 . . . . 0.0 110.383 178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.501 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -53.24 -46.68 69.27 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.75 -26.26 14.1 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.128 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.333 18.1 mt -64.77 -82.64 0.03 OUTLIER Pre-proline 0 N--CA 1.43 -1.471 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 -169.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.28 163.8 36.94 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 CA-C-N 127.405 3.68 . . . . 0.0 112.393 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -99.44 0.07 Allowed 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.525 1.13 . . . . 0.0 113.717 -165.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -111.66 -35.66 5.7 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.218 -1.551 . . . . 0.0 108.207 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 16.5 mtmt 63.1 61.41 1.1 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.897 2.479 . . . . 0.0 111.607 -172.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.317 2.5 mpt_? . . . . . 0 C--O 1.26 1.652 0 C-N-CA 128.889 2.876 . . . . 0.0 112.412 -165.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 CA--C 1.491 -1.309 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 2.5 ttt85 67.34 137.82 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 0.0 114.654 -175.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 28.1 ptm -71.99 52.57 0.24 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 119.757 3.243 . . . . 0.0 119.757 -166.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -104.08 -156.15 0.56 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.568 -1.957 . . . . 0.0 112.816 177.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . 0.42 HG22 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.428 HD23 ' HB2' ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -53.96 -43.23 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -57.94 -37.11 73.51 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.272 1.429 . . . . 0.0 114.725 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 13.1 mmp_? -70.67 -39.13 73.73 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.219 -0.926 . . . . 0.0 112.838 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -73.27 -44.75 58.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.453 1.501 . . . . 0.0 113.325 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.21 -18.8 39.95 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.689 2.396 . . . . 0.0 115.637 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -58.48 -41.88 86.26 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 170.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 . . . . . 0 C--O 1.261 1.679 0 C-N-CA 123.654 0.782 . . . . 0.0 112.276 -169.829 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.327 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 p -64.83 154.86 35.87 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -166.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -89.68 -63.0 1.35 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.774 1.23 . . . . 0.0 109.054 -176.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 m 77.59 29.02 0.55 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.215 1.806 . . . . 0.0 115.593 163.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t -51.49 -54.27 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 C-N-CA 127.54 2.336 . . . . 0.0 113.514 176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.332 0.0 OUTLIER -80.0 -18.14 51.04 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -72.16 -56.58 5.32 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.203 -1.56 . . . . 0.0 112.444 173.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -46.8 -42.79 17.66 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.326 1.851 . . . . 0.0 114.601 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -54.56 -23.48 16.93 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.693 1.997 . . . . 0.0 116.092 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.79 -27.73 69.09 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 118.944 -2.348 . . . . 0.0 113.725 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -116.02 26.12 10.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.903 -1.123 . . . . 0.0 113.242 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.7 p -95.43 164.5 12.79 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.18 -1.575 . . . . 0.0 112.824 175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -104.97 150.75 24.65 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.008 2.123 . . . . 0.0 107.747 169.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.46 -56.78 5.07 Favored Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.26 -1.525 . . . . 0.0 115.226 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 23.7 76.08 0.25 Allowed Pre-proline 0 N--CA 1.431 -1.406 0 C-N-CA 131.067 3.747 . . . . 0.0 119.029 -176.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -80.19 14.05 2.04 Favored 'Trans proline' 0 N--CA 1.434 -2.012 0 C-N-CA 123.186 2.591 . . . . 0.0 116.796 -172.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 63.18 120.13 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 128.564 2.746 . . . . 0.0 114.645 -169.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 ptt85 -159.69 -77.21 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.967 0.907 . . . . 0.0 110.005 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.81 58.81 1.09 Allowed Glycine 0 N--CA 1.43 -1.763 0 C-N-CA 124.59 1.091 . . . . 0.0 110.567 -171.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.367 0.0 OUTLIER 46.28 -133.14 1.02 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.219 2.208 . . . . 0.0 114.625 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p -91.64 127.4 37.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 158.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.531 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.531 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -66.44 -23.8 66.35 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -87.85 -20.37 26.13 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.48 1.512 . . . . 0.0 112.023 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.7 mt -108.77 104.25 54.05 Favored Pre-proline 0 N--CA 1.43 -1.455 0 O-C-N 120.963 -1.086 . . . . 0.0 112.932 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -76.21 117.83 4.76 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 123.311 2.674 . . . . 0.0 113.716 -174.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.77 -54.57 3.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.631 1.205 . . . . 0.0 111.815 177.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.0 -51.29 0.14 Allowed 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.319 47.8 mtpt 78.45 23.22 0.68 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.052 2.541 . . . . 0.0 114.345 176.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.297 27.8 mmt180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 128.136 2.574 . . . . 0.0 115.888 173.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 73.9 t . . . . . 0 CA--C 1.489 -1.367 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -69.19 98.34 1.01 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -168.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.301 51.3 mtp 58.43 80.57 0.18 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.828 2.851 . . . . 0.0 116.328 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -139.96 166.47 24.55 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.291 1.437 . . . . 0.0 107.602 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 -56.75 -30.87 64.01 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -76.03 -35.69 59.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.456 -1.403 . . . . 0.0 112.883 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -65.1 -26.28 68.14 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.294 -1.504 . . . . 0.0 113.943 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -80.27 -19.62 46.34 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -78.81 -18.49 54.0 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.797 -1.189 . . . . 0.0 112.572 175.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.61 -55.42 35.12 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.91 1.684 . . . . 0.0 115.54 -174.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 C--O 1.261 1.676 0 C-N-CA 125.677 1.591 . . . . 0.0 114.519 176.65 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 . . . . . 0 CA--C 1.49 -1.346 0 CA-C-O 121.514 0.673 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.2 p -143.57 173.87 11.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.065 0.946 . . . . 0.0 109.376 172.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -120.7 130.0 53.89 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 167.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 m -117.47 34.74 4.99 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 120.065 -1.647 . . . . 0.0 112.23 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.5 -54.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 126.342 1.857 . . . . 0.0 112.848 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.417 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -21.94 64.5 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -42.45 -40.61 2.63 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 129.784 3.234 . . . . 0.0 118.206 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -79.82 -18.69 50.27 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -79.42 -70.87 0.48 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.051 -1.03 . . . . 0.0 112.394 -176.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.4 mt 52.12 -122.23 1.97 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.119 2.168 . . . . 0.0 114.521 -171.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -100.51 85.49 2.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.335 -1.478 . . . . 0.0 109.527 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 t -74.06 137.32 43.27 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.575 1.178 . . . . 0.0 114.053 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -83.75 -59.86 2.3 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.05 1.74 . . . . 0.0 111.67 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -111.79 -58.86 0.45 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.37 -0.831 . . . . 0.0 112.703 -173.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -88.42 129.74 48.23 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -164.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -77.78 151.1 27.87 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 C-N-CA 122.549 2.166 . . . . 0.0 111.818 165.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -118.77 163.22 17.19 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.231 1.412 . . . . 0.0 111.502 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -108.43 -55.41 2.39 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.863 1.265 . . . . 0.0 111.223 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 140.73 -154.11 24.09 Favored Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.02 -138.6 0.11 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 163.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -74.45 121.85 22.1 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.907 -1.746 . . . . 0.0 110.583 167.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.52 -45.41 72.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -98.22 -18.92 18.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.2 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.327 1.0 OUTLIER -37.01 -71.55 0.11 Allowed Pre-proline 0 N--CA 1.43 -1.439 1 N-CA-C 121.999 4.074 . . . . 0.0 121.999 -170.798 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -80.69 176.18 9.32 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.839 3.026 . . . . 0.0 114.455 -169.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.01 -33.92 67.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.18 -108.04 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 176.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -143.57 -55.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 110.388 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.285 59.2 mtt180 . . . . . 0 C--O 1.26 1.617 0 N-CA-C 115.95 1.833 . . . . 0.0 115.95 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -90.13 139.94 30.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.441 -1.412 . . . . 0.0 111.372 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.8 ttp -100.5 -69.29 0.78 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.093 -1.004 . . . . 0.0 110.237 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 50.12 -141.05 0.74 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.936 2.494 . . . . 0.0 112.856 -174.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -56.88 -34.56 67.98 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -64.63 -35.57 81.45 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 125.233 1.413 . . . . 0.0 113.958 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 59.3 mmt-85 -66.29 -41.4 89.84 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.433 1.493 . . . . 0.0 112.132 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.21 -30.61 67.74 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.681 -1.262 . . . . 0.0 113.572 177.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -72.31 -25.4 61.55 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.019 0.928 . . . . 0.0 113.369 171.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -42.11 75.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.16 1.384 . . . . 0.0 113.552 -173.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 C--O 1.26 1.614 0 C-N-CA 124.32 1.048 . . . . 0.0 111.621 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 . . . . . 0 CA--C 1.49 -1.331 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m 72.76 174.18 0.29 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.852 2.461 . . . . 0.0 113.837 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.19 -98.83 0.24 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.203 -1.561 . . . . 0.0 109.044 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -105.15 88.08 2.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.276 1.988 . . . . 0.0 112.575 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.61 -52.56 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.736 2.015 . . . . 0.0 109.121 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.416 ' HB3' HD12 ' A' ' 27' ' ' ILE . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.434 HG21 HG22 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.71 -20.86 61.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -47.53 -47.06 28.15 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.668 1.987 . . . . 0.0 114.84 172.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -81.85 -57.52 3.39 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.094 0.958 . . . . 0.0 111.57 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 64.94 -44.33 0.33 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 129.24 3.016 . . . . 0.0 116.872 -175.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.6 mt -84.36 145.91 27.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.605 -1.309 . . . . 0.0 113.36 -164.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.6 m80 -94.71 80.9 3.79 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.332 -1.48 . . . . 0.0 109.631 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.2 p -117.13 153.47 32.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-O 122.865 1.317 . . . . 0.0 113.216 -171.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -87.96 118.28 27.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.057 1.343 . . . . 0.0 108.876 167.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 142.84 -55.5 0.58 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -76.11 155.11 84.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 120.787 -1.419 . . . . 0.0 114.026 -173.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -81.09 -168.57 0.64 Allowed 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 122.647 2.232 . . . . 0.0 111.63 162.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.45 -138.74 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.458 1 C-N-CA 132.177 4.191 . . . . 0.0 120.139 172.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 74.75 -68.65 0.21 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.255 2.622 . . . . 0.0 112.169 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.92 122.32 5.71 Favored Glycine 0 N--CA 1.43 -1.749 0 N-CA-C 108.843 -1.703 . . . . 0.0 108.843 176.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -139.98 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -149.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m -113.4 145.92 40.35 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.078 1.351 . . . . 0.0 110.674 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.434 HG22 HG21 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.477 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.53 -22.53 58.98 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.73 -5.04 49.33 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.189 1.396 . . . . 0.0 110.108 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.1 mt -108.74 170.77 5.1 Favored Pre-proline 0 N--CA 1.43 -1.448 0 O-C-N 120.917 -1.115 . . . . 0.0 111.935 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -64.39 146.32 89.53 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 C-N-CA 122.348 2.032 . . . . 0.0 114.805 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -60.19 -46.94 87.99 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -162.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.08 -40.87 0.06 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.152 -1.592 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.268 41.6 mtpt 75.18 45.01 0.15 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 129.163 2.985 . . . . 0.0 111.825 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.797 1.239 . . . . 0.0 112.153 -177.368 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.49 -1.339 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 62.2 -147.21 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.622 1.169 . . . . 0.0 113.905 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 16.9 ttt -36.35 103.79 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.332 2.653 . . . . 0.0 117.512 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -158.06 -177.86 6.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 108.69 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -55.12 -43.46 74.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.5 -30.68 66.24 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.406 1.483 . . . . 0.0 113.949 176.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -64.85 -41.67 95.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.384 -1.448 . . . . 0.0 113.847 170.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -73.71 -21.03 60.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.462 -2.023 . . . . 0.0 114.499 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.75 -17.35 62.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 167.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -58.5 -18.0 25.67 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.26 1.645 0 N-CA-C 117.326 2.343 . . . . 0.0 117.326 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 CA--C 1.49 -1.359 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.7 p -108.71 103.94 13.13 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.916 -1.115 . . . . 0.0 111.736 -170.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -85.85 -84.03 0.17 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.855 -1.153 . . . . 0.0 111.153 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -138.1 29.42 2.51 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.487 1.137 . . . . 0.0 111.441 -164.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.38 -49.42 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.702 2.001 . . . . 0.0 110.417 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.431 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.431 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.456 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -19.19 60.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.8 mmmt -64.5 -45.48 87.09 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.744 -1.848 . . . . 0.0 112.343 170.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -63.03 -40.93 99.2 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -74.43 -25.96 59.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mt -6.7 76.88 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 131.034 3.734 . . . . 0.0 120.188 -176.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 81.5 t60 39.05 54.78 2.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.768 2.827 . . . . 0.0 115.064 -177.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 t -73.68 139.12 45.17 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.964 -1.085 . . . . 0.0 113.732 -168.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -95.18 142.91 27.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.847 -1.158 . . . . 0.0 110.507 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.11 -103.44 1.31 Allowed Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -93.8 166.67 15.32 Favored Pre-proline 0 N--CA 1.429 -1.482 0 C-N-CA 124.351 1.061 . . . . 0.0 111.716 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.11 160.82 39.36 Favored 'Trans proline' 0 C--N 1.3 -2.019 0 C-N-CA 122.045 1.83 . . . . 0.0 111.668 160.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -127.65 158.36 37.77 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.062 0.945 . . . . 0.0 108.476 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -99.5 -78.44 0.5 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 160.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.28 -133.29 4.17 Favored Glycine 0 N--CA 1.429 -1.777 0 N-CA-C 106.091 -2.804 . . . . 0.0 106.091 -176.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.35 -157.96 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.068 2.147 . . . . 0.0 114.328 165.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m -85.33 128.53 34.73 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.173 -2.205 . . . . 0.0 108.909 172.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.456 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -64.67 -25.66 68.05 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -97.64 -57.3 2.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.512 0.725 . . . . 0.0 110.527 160.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.333 16.7 mt -41.11 -65.13 0.5 Allowed Pre-proline 0 N--CA 1.43 -1.436 1 N-CA-C 122.365 4.209 . . . . 0.0 122.365 -148.937 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -69.94 126.64 13.42 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 124.642 2.694 . . . . 0.0 112.448 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -71.19 -53.63 13.77 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -165.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -130.78 -41.43 1.17 Allowed 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.902 -1.124 . . . . 0.0 109.878 -175.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.5 tttp 69.77 36.45 2.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.134 1.774 . . . . 0.0 114.404 170.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 . . . . . 0 C--O 1.26 1.633 0 O-C-N 120.145 -1.597 . . . . 0.0 112.634 178.843 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.489 -1.378 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -146.48 162.17 38.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.394 -1.441 . . . . 0.0 108.015 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.3 40.0 mmm 70.26 0.51 3.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -73.75 174.33 8.57 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.247 -1.533 . . . . 0.0 113.323 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -54.02 -37.99 64.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -75.5 -32.24 60.47 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.215 2.206 . . . . 0.0 115.042 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -34.95 67.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.446 -1.409 . . . . 0.0 111.588 171.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -65.17 -36.22 83.54 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.116 1.766 . . . . 0.0 114.565 173.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.88 -16.87 46.58 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 128.411 2.684 . . . . 0.0 116.316 173.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -56.6 -28.36 60.19 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.245 1.818 . . . . 0.0 114.933 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 C--O 1.26 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 108.912 163.667 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 CA--C 1.49 -1.332 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 m 78.05 137.65 0.06 Allowed 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 128.233 2.613 . . . . 0.0 115.72 171.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -70.43 -57.78 4.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.015 -1.678 . . . . 0.0 113.167 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -103.78 82.14 1.97 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.273 1.987 . . . . 0.0 110.656 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.26 -46.91 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 130.974 3.709 . . . . 0.0 110.022 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.401 ' HA ' HG12 ' A' ' 11' ' ' ILE . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.401 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -23.25 65.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -41.88 -49.3 4.51 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.679 2.392 . . . . 0.0 116.619 172.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -66.44 -19.29 65.76 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.268 1.427 . . . . 0.0 114.667 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.2 -10.68 46.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.805 -1.184 . . . . 0.0 113.038 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.58 -147.89 0.13 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.807 1.243 . . . . 0.0 111.233 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -113.63 56.68 0.69 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.314 -2.116 . . . . 0.0 110.501 -173.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.5 t -97.23 -38.91 9.51 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.952 -1.092 . . . . 0.0 111.284 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -127.18 -66.43 0.89 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 121.121 -0.987 . . . . 0.0 109.753 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 50.51 0.62 Allowed Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 125.339 1.447 . . . . 0.0 113.723 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -111.88 149.58 41.04 Favored Pre-proline 0 N--CA 1.429 -1.485 0 CA-C-O 117.633 -1.175 . . . . 0.0 109.982 167.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.22 118.06 5.36 Favored 'Trans proline' 0 N--CA 1.433 -2.044 0 C-N-CA 123.181 2.587 . . . . 0.0 111.283 174.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.7 167.86 29.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -161.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -104.66 -62.58 1.31 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.289 1.036 . . . . 0.0 108.947 170.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.67 -74.87 0.11 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.585 -1.322 . . . . 0.0 111.795 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -165.82 -136.15 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 127.387 2.275 . . . . 0.0 108.153 -164.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m -91.56 117.88 30.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.101 -0.999 . . . . 0.0 111.146 163.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -75.6 -28.24 58.81 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -84.36 -12.96 53.58 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 125.733 1.613 . . . . 0.0 109.782 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.4 102.9 53.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 C-N-CA 124.515 1.126 . . . . 0.0 112.155 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -68.97 105.76 1.41 Allowed 'Trans proline' 0 N--CA 1.433 -2.038 0 C-N-CA 123.065 2.51 . . . . 0.0 114.132 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.32 -42.08 31.79 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.079 -1.638 . . . . 0.0 113.807 177.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -132.81 -35.9 1.07 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.886 -1.134 . . . . 0.0 111.07 -173.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.308 47.3 mttm 100.18 9.33 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.471 1 C-N-CA 131.778 4.031 . . . . 0.0 112.039 -175.499 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.286 38.3 mtm180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 129.653 3.181 . . . . 0.0 113.998 178.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 120.543 0.211 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -144.24 153.04 41.64 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.888 -1.132 . . . . 0.0 112.032 -171.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 32.4 tpp -91.13 137.45 32.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.685 1.594 . . . . 0.0 111.664 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -160.63 179.32 8.66 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 166.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.417 HD12 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -68.35 -31.88 71.58 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.19 -30.02 57.87 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.212 -1.555 . . . . 0.0 112.273 172.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -68.27 -28.95 67.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.595 -1.315 . . . . 0.0 114.086 170.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -60.26 -24.63 65.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.291 2.236 . . . . 0.0 115.885 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.39 -21.53 66.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.421 1.488 . . . . 0.0 115.015 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -69.76 -22.1 63.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.26 1.619 0 O-C-N 120.698 -1.251 . . . . 0.0 111.034 -179.085 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 . . . . . 0 CA--C 1.491 -1.311 0 CA-C-O 122.525 1.155 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 m -68.95 143.98 54.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.653 -1.904 . . . . 0.0 114.08 -173.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -91.89 -59.16 2.18 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 122.452 1.12 . . . . 0.0 109.675 -177.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -92.27 88.14 6.34 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.35 2.024 . . . . 0.0 114.434 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t -76.64 -45.4 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 127.471 2.308 . . . . 0.0 109.301 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.406 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.3 m-70 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -44.44 22.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -75.4 -57.85 3.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.311 1.444 . . . . 0.0 113.154 -172.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -50.1 -45.27 52.62 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.232 1.813 . . . . 0.0 114.707 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -76.8 -4.88 45.84 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.432 1.493 . . . . 0.0 114.96 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 mt -82.17 27.75 0.47 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.255 -2.153 . . . . 0.0 115.221 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -95.59 41.33 1.1 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.66 -1.9 . . . . 0.0 110.473 170.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.9 t -139.43 132.2 29.09 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 173.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -8.82 -87.75 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 130.082 3.353 . . . . 0.0 119.643 -161.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.98 46.27 0.89 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.067 -1.646 . . . . 0.0 111.243 175.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -125.52 123.95 25.0 Favored Pre-proline 0 N--CA 1.429 -1.507 0 O-C-N 121.577 -0.955 . . . . 0.0 113.093 -174.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.97 115.24 3.98 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 122.525 2.15 . . . . 0.0 111.225 165.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -158.17 166.7 31.77 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.698 -0.626 . . . . 0.0 109.728 -173.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 85.81 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.866 2.866 . . . . 0.0 112.451 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.36 -168.9 41.34 Favored Glycine 0 N--CA 1.43 -1.722 0 C-N-CA 124.982 1.277 . . . . 0.0 111.995 -155.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.36 -132.53 0.3 Allowed 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.548 -1.56 . . . . 0.0 108.32 158.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -71.58 112.74 7.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.611 1.165 . . . . 0.0 111.227 172.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.406 ' HB3' HG23 ' A' ' 27' ' ' ILE . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -73.19 -35.97 66.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.37 -14.07 47.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.376 1.87 . . . . 0.0 109.863 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.5 mt -91.87 170.2 9.81 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 124.595 1.158 . . . . 0.0 111.26 171.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -68.17 153.13 75.4 Favored 'Trans proline' 0 N--CA 1.433 -2.03 0 C-N-CA 122.062 1.841 . . . . 0.0 112.868 166.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -69.84 -40.95 75.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -174.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.73 -96.73 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt -152.66 74.59 1.07 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 169.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 125.995 1.718 . . . . 0.0 112.385 -175.427 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 116.69 2.107 . . . . 0.0 116.69 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.271 42.3 mtp85 76.66 168.59 0.25 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.343 1.857 . . . . 0.0 114.028 173.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.7 ptm -116.51 109.19 16.94 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.976 1.37 . . . . 0.0 112.341 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.962 1.705 . . . . 0.0 107.019 170.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -64.09 -38.32 90.65 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -64.57 -26.48 68.43 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.611 -1.306 . . . . 0.0 114.127 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -70.1 -47.19 62.87 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.436 -1.415 . . . . 0.0 112.484 166.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -54.78 -37.53 66.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.715 1.606 . . . . 0.0 115.077 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -45.59 -19.07 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 129.711 3.205 . . . . 0.0 118.978 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -18.54 64.86 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.537 -1.977 . . . . 0.0 115.127 170.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.26 1.605 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . 0.467 ' HG2' ' H ' ' A' ' 2' ' ' SER 0.284 0.6 OUTLIER . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 119.444 -0.312 . . . . 0.0 110.694 . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.467 ' H ' ' HG2' ' A' ' 1' ' ' GLU . 10.2 m -166.78 143.83 4.8 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.285 -1.509 . . . . 0.0 107.017 166.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 p30 -104.84 -82.36 0.52 Allowed 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 124.216 1.006 . . . . 0.0 110.905 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.3 m -138.11 36.35 2.33 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.473 1.909 . . . . 0.0 108.593 -173.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.1 t -48.66 -53.67 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 128.126 2.57 . . . . 0.0 114.224 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.439 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.439 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -18.92 60.94 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -59.39 -42.11 90.95 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.168 -1.582 . . . . 0.0 113.532 172.092 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.94 -19.1 64.17 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 -170.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.98 -30.54 71.54 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.941 2.496 . . . . 0.0 114.136 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.0 mt -89.57 170.33 10.58 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.271 1.028 . . . . 0.0 111.366 -173.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -82.01 73.81 9.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.618 -1.926 . . . . 0.0 110.335 169.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -81.96 -68.87 0.66 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.815 1.646 . . . . 0.0 111.347 -173.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -101.79 -56.3 2.31 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.356 -1.465 . . . . 0.0 111.138 -174.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.91 -66.93 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.764 0 O-C-N 121.495 -0.753 . . . . 0.0 112.278 -175.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -109.95 158.79 34.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 121.775 -0.838 . . . . 0.0 112.039 -172.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.97 123.61 8.03 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.172 1.915 . . . . 0.0 113.85 173.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -100.2 161.43 13.61 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 158.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.1 mtp-105 -76.64 -48.94 17.47 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.526 -1.984 . . . . 0.0 115.703 -166.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 118.77 70.5 0.35 Allowed Glycine 0 N--CA 1.43 -1.723 0 N-CA-C 108.169 -1.972 . . . . 0.0 108.169 -167.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.421 0.0 OUTLIER 17.21 -146.59 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.404 1 C-N-CA 132.807 4.443 . . . . 0.0 120.68 -173.819 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p -95.16 132.09 40.48 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.617 -1.302 . . . . 0.0 109.02 167.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -67.8 -37.9 82.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -72.2 -60.65 2.13 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 123.607 0.763 . . . . 0.0 111.208 157.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 mt -74.26 116.5 53.33 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -159.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.04 96.63 1.09 Allowed 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.707 2.271 . . . . 0.0 112.401 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -85.27 -43.6 13.61 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.61 -15.07 0.38 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.848 -1.158 . . . . 0.0 112.777 -170.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 61.07 31.98 19.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.283 2.633 . . . . 0.0 112.811 -167.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 91.7 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 126.944 2.098 . . . . 0.0 109.006 -171.042 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -115.61 -173.66 2.38 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.852 -1.155 . . . . 0.0 110.589 177.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.1 tpt -55.06 75.79 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.347 3.459 . . . . 0.0 115.265 167.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -127.08 -178.29 4.37 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.454 -1.404 . . . . 0.0 111.071 170.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -58.77 -40.74 84.81 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -68.17 -26.49 65.78 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.854 -1.154 . . . . 0.0 113.719 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -69.62 -26.71 64.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.407 -1.433 . . . . 0.0 114.043 177.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -73.87 -30.05 62.43 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.025 -1.672 . . . . 0.0 113.551 172.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -69.48 -15.8 63.34 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.668 1.587 . . . . 0.0 113.876 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.04 -18.31 63.29 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.854 -1.779 . . . . 0.0 114.746 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 C--O 1.261 1.678 0 O-C-N 120.927 -1.108 . . . . 0.0 113.892 -175.674 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -152.42 110.13 3.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.943 -1.098 . . . . 0.0 108.636 168.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -101.85 107.65 18.89 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.378 -0.826 . . . . 0.0 111.765 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.0 m -144.57 85.38 1.77 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.192 0.997 . . . . 0.0 111.172 -175.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.87 -45.34 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 127.926 2.49 . . . . 0.0 111.549 177.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.4 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.426 HG22 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.414 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB2' HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 71.6 m-70 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.26 -15.52 58.69 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -40.62 -39.16 1.0 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.788 2.835 . . . . 0.0 117.744 178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -58.5 -27.81 64.81 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.204 2.202 . . . . 0.0 115.703 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 69.49 8.71 6.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.776 2.83 . . . . 0.0 115.379 175.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.251 92.9 mt 73.45 109.75 0.07 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 129.502 3.121 . . . . 0.0 113.338 -173.417 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -127.33 76.16 1.64 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 124.703 1.201 . . . . 0.0 107.832 169.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.356 12.2 t 47.2 -143.54 0.36 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 128.361 2.664 . . . . 0.0 115.082 176.229 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -128.58 134.78 48.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.677 -1.889 . . . . 0.0 106.229 160.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.28 -86.44 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.084 -1.01 . . . . 0.0 111.584 -177.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -106.54 162.5 19.5 Favored Pre-proline 0 N--CA 1.43 -1.456 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.209 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -65.19 138.69 57.28 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 CA-C-N 123.151 2.161 . . . . 0.0 115.068 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -115.98 -164.48 0.96 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.241 1.417 . . . . 0.0 108.328 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -73.24 -22.95 60.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.69 -1.881 . . . . 0.0 115.208 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.89 157.72 53.16 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-O 123.299 1.499 . . . . 0.0 112.227 175.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.67 -141.29 0.34 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.517 1.527 . . . . 0.0 110.22 -170.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.9 p -109.96 146.0 35.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.452 1.501 . . . . 0.0 110.983 -178.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HB3' HG22 ' A' ' 27' ' ' ILE . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -55.11 -40.08 70.06 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -93.29 -38.16 11.66 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 123.844 0.858 . . . . 0.0 110.531 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.72 146.29 31.47 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -160.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.94 150.6 61.28 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.818 2.345 . . . . 0.0 114.315 -170.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -76.18 -74.55 0.22 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -153.67 -54.18 0.11 Allowed 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.674 -1.266 . . . . 0.0 107.942 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 68.69 28.24 5.69 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.748 2.019 . . . . 0.0 113.481 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 C--O 1.26 1.621 0 C-N-CA 126.626 1.97 . . . . 0.0 114.008 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 CA--C 1.49 -1.347 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -149.98 78.53 1.35 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.286 1.035 . . . . 0.0 109.484 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.0 mmt 64.22 23.37 13.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.995 2.118 . . . . 0.0 115.83 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -54.56 140.88 33.41 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.915 1.686 . . . . 0.0 112.982 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -58.25 -28.2 64.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.82 -26.56 64.26 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.056 2.143 . . . . 0.0 114.535 175.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -38.48 77.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.594 -1.316 . . . . 0.0 113.222 173.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -81.08 -20.46 41.47 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.29 -1.506 . . . . 0.0 112.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.25 -17.89 22.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.467 1.907 . . . . 0.0 115.417 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -62.07 -18.64 61.33 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.427 2.01 . . . . 0.0 116.427 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . 0.436 ' OXT' ' CD2' ' B' ' 221' ' ' HIS . 11.2 p-80 . . . . . 0 C--O 1.26 1.627 0 C-N-CA 127.536 2.334 . . . . 0.0 116.704 -171.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 CA--C 1.49 -1.362 0 CA-C-O 119.86 -0.115 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m -147.32 167.16 25.01 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 161.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -99.4 -90.06 0.31 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.389 -0.82 . . . . 0.0 110.437 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.6 m -79.28 89.71 4.94 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.933 1.349 . . . . 0.0 112.242 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t -80.49 -48.22 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 127.252 2.221 . . . . 0.0 109.578 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.411 ' O ' HG12 ' A' ' 11' ' ' ILE . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.421 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.415 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.13 -19.14 58.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.8 tttm -52.68 -40.04 62.5 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.296 2.238 . . . . 0.0 114.423 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -72.17 -20.54 61.57 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.846 -1.159 . . . . 0.0 113.847 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -74.29 -19.87 60.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.996 -1.065 . . . . 0.0 112.616 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.79 -65.4 1.01 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.803 1.241 . . . . 0.0 113.225 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -144.74 65.21 1.28 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.318 -1.489 . . . . 0.0 112.636 -174.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.7 t -83.31 127.6 33.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.485 0.66 . . . . 0.0 111.507 167.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -122.52 74.59 1.19 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.071 -1.643 . . . . 0.0 109.131 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.67 -76.12 0.11 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.64 -1.288 . . . . 0.0 110.809 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -93.04 117.18 67.43 Favored Pre-proline 0 N--CA 1.43 -1.452 0 O-C-N 121.722 -0.869 . . . . 0.0 110.644 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.75 98.11 1.12 Allowed 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.804 2.336 . . . . 0.0 111.274 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.61 173.79 6.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.955 1.359 . . . . 0.0 112.086 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -138.14 -115.38 0.16 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 168.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.9 162.27 42.68 Favored Glycine 0 N--CA 1.43 -1.763 0 O-C-N 120.415 -1.428 . . . . 0.0 113.273 169.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.73 -116.91 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.133 1.773 . . . . 0.0 108.707 169.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -86.32 117.88 25.41 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.342 -1.474 . . . . 0.0 110.015 149.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -46.61 -40.08 12.32 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -92.04 -53.26 4.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.337 1.055 . . . . 0.0 110.587 172.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.313 79.7 mt -65.4 -79.55 0.05 OUTLIER Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -149.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.82 143.37 33.25 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 CA-C-N 126.345 3.302 . . . . 0.0 113.053 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.3 -72.85 0.26 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.773 1.229 . . . . 0.0 113.613 -176.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.35 -54.11 0.22 Allowed 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.882 -1.137 . . . . 0.0 108.358 174.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 18.5 mmtp 80.46 -19.7 0.42 Allowed 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 129.001 2.92 . . . . 0.0 114.462 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.9 mmm-85 . . . . . 0 C--O 1.26 1.635 0 C-N-CA 128.676 2.791 . . . . 0.0 113.864 -175.955 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 CA--C 1.491 -1.327 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -74.6 171.31 14.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.493 -2.004 . . . . 0.0 112.781 172.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 11.4 ptm -76.21 74.44 3.03 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 123.544 1.64 . . . . 0.0 110.434 167.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -90.26 -177.96 5.26 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.088 1.755 . . . . 0.0 112.391 -167.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.17 -36.6 73.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.89 -44.58 84.86 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.67 1.588 . . . . 0.0 112.216 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -72.39 -37.7 68.65 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -69.27 -30.1 68.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.175 1.39 . . . . 0.0 114.737 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -51.94 -37.44 52.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 -176.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.27 -49.72 10.4 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 C--O 1.26 1.657 0 C-N-CA 128.472 2.709 . . . . 0.0 116.563 -173.852 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.5 p -156.14 111.3 2.92 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 121.852 2.115 . . . . 0.0 115.78 165.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -79.68 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.181 1.393 . . . . 0.0 111.643 171.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -93.49 23.58 4.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.999 -1.688 . . . . 0.0 114.033 -168.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t -63.11 -48.68 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.676 1.99 . . . . 0.0 112.038 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? -61.99 -25.53 67.69 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -48.31 -32.49 7.46 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.159 2.584 . . . . 0.0 116.325 174.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -25.87 5.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.172 2.189 . . . . 0.0 116.526 171.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -73.04 -19.03 61.26 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.593 1.557 . . . . 0.0 113.836 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.26 161.39 29.96 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.989 -1.694 . . . . 0.0 113.465 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -84.91 69.75 10.81 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.24 1.416 . . . . 0.0 111.121 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.5 m -78.58 150.27 32.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.243 1.817 . . . . 0.0 109.801 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -85.18 135.35 33.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.033 -1.667 . . . . 0.0 110.964 -176.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.71 -70.49 3.17 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.087 -1.633 . . . . 0.0 114.607 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.298 0.0 OUTLIER 18.24 80.23 0.12 Allowed Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 121.468 3.877 . . . . 0.0 121.468 -176.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -80.21 0.36 10.07 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 C-N-CA 122.275 1.983 . . . . 0.0 114.245 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -172.6 160.05 4.56 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.688 2.795 . . . . 0.0 107.729 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.293 10.6 ptp180 -176.48 -42.94 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.028 1.331 . . . . 0.0 113.994 150.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.7 49.11 4.18 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.219 -1.551 . . . . 0.0 115.765 -172.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.8 ptt? 37.22 -138.8 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 118.933 2.938 . . . . 0.0 118.933 156.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m -116.22 144.16 44.56 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.136 1.374 . . . . 0.0 109.164 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.525 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 27' ' ' ILE . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -42.87 -43.63 4.15 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -108.61 -43.74 4.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.938 1.295 . . . . 0.0 111.577 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.4 mt -75.66 161.54 75.81 Favored Pre-proline 0 N--CA 1.43 -1.446 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -163.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -62.53 130.02 28.54 Favored 'Trans proline' 0 N--CA 1.433 -2.031 0 C-N-CA 122.629 2.219 . . . . 0.0 113.312 171.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -70.05 -69.01 0.38 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -166.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -117.7 -65.36 1.19 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.9 ttmt -161.56 -69.67 0.06 Allowed 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.825 162.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.638 0 C-N-CA 125.243 1.417 . . . . 0.0 112.047 -175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 CA--C 1.491 -1.314 0 CA-C-O 120.86 0.362 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -94.73 160.12 14.76 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 124.091 0.957 . . . . 0.0 110.872 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.9 ptm -70.29 63.0 0.24 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -90.85 -176.8 4.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.487 -2.008 . . . . 0.0 112.675 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -60.87 -24.25 65.8 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.69 -44.68 77.59 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.692 1.597 . . . . 0.0 113.961 169.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -67.88 -20.34 65.11 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.245 -1.534 . . . . 0.0 114.216 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -77.34 -24.78 50.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.61 -1.306 . . . . 0.0 112.771 175.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -77.81 -30.31 51.13 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.941 -1.099 . . . . 0.0 111.614 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -71.6 -50.04 34.65 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.64 -1.287 . . . . 0.0 112.357 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.254 68.1 m80 . . . . . 0 C--O 1.259 1.579 0 C-N-CA 127.072 2.149 . . . . 0.0 112.705 -175.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.491 -1.292 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.25 70.0 m 75.27 168.7 0.28 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.166 2.186 . . . . 0.0 112.685 179.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -149.61 -91.87 0.07 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.555 -1.341 . . . . 0.0 109.491 177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 m -112.67 26.55 10.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.162 -1.586 . . . . 0.0 112.931 -175.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.78 -56.54 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 127.072 2.149 . . . . 0.0 110.831 -176.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HZ1' ' CD ' ' A' ' 75' ' ' GLU . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.442 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -19.29 64.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -40.45 -45.26 2.18 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 129.492 3.117 . . . . 0.0 117.235 175.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.9 -31.35 71.64 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -81.31 -8.33 59.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.988 1.315 . . . . 0.0 112.697 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.7 mt -77.16 -55.28 5.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.667 -1.271 . . . . 0.0 109.914 166.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.73 -47.18 55.55 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -176.061 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.348 29.2 p 67.37 -137.63 0.12 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.536 1.934 . . . . 0.0 114.922 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt 42.45 50.66 4.76 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 129.392 3.077 . . . . 0.0 117.272 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.14 50.34 0.83 Allowed Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.898 1.237 . . . . 0.0 112.679 177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.4 ptt85 -72.33 114.5 30.18 Favored Pre-proline 0 N--CA 1.43 -1.43 0 O-C-N 121.858 -0.789 . . . . 0.0 111.877 174.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -90.45 -2.66 5.21 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 122.761 2.022 . . . . 0.0 114.097 -159.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -151.06 -161.15 1.28 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.547 1.539 . . . . 0.0 107.367 -177.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 32.0 ptt85 -129.07 72.74 1.48 Allowed 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.25 1.5 . . . . 0.0 110.487 170.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.4 -96.39 0.28 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.98 1.752 . . . . 0.0 112.341 -172.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.59 -153.61 0.48 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.103 1.361 . . . . 0.0 109.621 -171.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m -78.42 131.74 37.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 119.77 -1.831 . . . . 0.0 112.644 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.442 ' HB3' HG21 ' A' ' 27' ' ' ILE . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.428 ' CD ' ' HZ1' ' A' ' 16' ' ' LYS . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.55 -21.98 38.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -72.76 -30.81 64.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.086 1.354 . . . . 0.0 110.327 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.15 162.52 40.24 Favored Pre-proline 0 N--CA 1.43 -1.433 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -172.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 125.63 9.24 Favored 'Trans proline' 0 C--N 1.299 -2.033 0 C-N-CA 122.399 2.066 . . . . 0.0 113.84 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -108.69 -42.28 4.56 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 123.361 0.664 . . . . 0.0 110.957 162.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.87 -106.92 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm -131.29 36.63 3.79 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.248 -0.908 . . . . 0.0 110.112 157.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 C--O 1.261 1.673 0 O-C-N 120.301 -1.499 . . . . 0.0 109.833 173.806 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 CA--C 1.491 -1.317 0 CA-C-O 119.112 -0.471 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -107.77 -153.94 0.51 Allowed 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 120.464 1.484 . . . . 0.0 108.352 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 45.1 mtp -84.7 -110.07 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.797 -1.19 . . . . 0.0 110.351 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 75.63 162.7 0.25 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.084 1.754 . . . . 0.0 112.473 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.96 -25.15 61.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.3 -27.56 53.02 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.206 1.002 . . . . 0.0 112.465 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -28.88 69.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.967 1.307 . . . . 0.0 113.357 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.48 -27.37 66.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.966 2.106 . . . . 0.0 115.651 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.79 -27.18 55.15 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.088 -1.632 . . . . 0.0 112.774 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -70.19 -56.21 7.4 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.371 1.068 . . . . 0.0 113.099 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.297 74.5 m80 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 127.4 2.28 . . . . 0.0 113.146 -176.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.33 49.0 m 85.37 117.73 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.36 3.064 . . . . 0.0 114.052 -176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.67 -74.05 0.28 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.997 1.719 . . . . 0.0 111.735 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.6 p -151.15 92.16 1.77 Allowed 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.152 1.381 . . . . 0.0 109.567 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t -75.72 -43.31 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.557 1.943 . . . . 0.0 108.125 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.422 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' HB2' HD23 ' B' ' 206' ' ' LEU . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -21.89 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -44.61 -47.39 10.4 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 129.396 3.078 . . . . 0.0 116.648 166.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.34 -26.2 68.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.63 1.572 . . . . 0.0 114.47 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -77.33 -32.71 55.39 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.101 -1.625 . . . . 0.0 112.607 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.55 -50.05 8.05 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.021 -1.05 . . . . 0.0 112.088 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -114.2 73.66 0.83 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.829 1.652 . . . . 0.0 108.353 -177.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -77.03 122.49 25.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.694 1.198 . . . . 0.0 114.014 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -91.36 69.66 5.98 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.219 1.485 . . . . 0.0 113.376 -167.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.67 -66.21 3.88 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.111 -1.618 . . . . 0.0 114.41 177.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -80.39 141.64 53.35 Favored Pre-proline 0 N--CA 1.43 -1.427 0 O-C-N 120.986 -1.302 . . . . 0.0 111.452 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -75.88 100.96 1.43 Allowed 'Trans proline' 0 C--N 1.3 -2.019 0 CA-C-N 123.108 2.146 . . . . 0.0 111.996 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -125.21 154.68 41.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.317 1.447 . . . . 0.0 108.782 -172.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -113.29 -79.38 0.58 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.157 0.983 . . . . 0.0 110.23 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.29 169.71 25.73 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-O 123.675 1.708 . . . . 0.0 112.934 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -143.48 0.11 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.822 2.449 . . . . 0.0 111.19 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m -72.3 123.73 23.61 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.959 -1.713 . . . . 0.0 110.826 167.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.54 -20.8 65.46 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -90.92 -13.34 33.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 123.989 0.916 . . . . 0.0 110.131 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.95 93.93 48.89 Favored Pre-proline 0 N--CA 1.431 -1.388 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -63.36 108.01 0.77 Allowed 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 123.977 3.118 . . . . 0.0 112.658 168.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.41 -56.54 6.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 -169.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -161.31 -19.56 0.05 OUTLIER 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -172.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.259 74.6 tttt 77.45 66.74 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 128.307 2.643 . . . . 0.0 111.974 -169.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 . . . . . 0 C--O 1.261 1.662 0 C-N-CA 126.526 1.931 . . . . 0.0 109.619 175.757 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 121.061 0.457 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -127.08 131.53 50.86 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.779 -1.201 . . . . 0.0 109.375 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 29.5 mtp -75.52 93.46 3.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.221 -0.924 . . . . 0.0 111.208 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -131.2 173.06 11.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 171.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.429 HD23 ' HB2' ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -64.42 -47.41 79.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -67.2 -38.83 85.98 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.384 1.073 . . . . 0.0 112.634 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -72.49 -23.53 61.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -74.05 -45.0 52.27 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 120.182 -1.574 . . . . 0.0 112.662 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.83 -29.38 54.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.722 2.009 . . . . 0.0 115.574 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -53.97 -43.7 70.13 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.611 2.364 . . . . 0.0 114.472 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 128.087 2.555 . . . . 0.0 115.898 -173.842 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.005 0.431 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.285 72.4 m 78.52 118.46 0.06 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.878 2.471 . . . . 0.0 115.208 170.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -87.43 -17.1 33.0 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.655 1.582 . . . . 0.0 111.179 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.0 m -76.7 82.03 3.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.247 2.219 . . . . 0.0 114.278 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t -81.34 -59.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.041 2.136 . . . . 0.0 110.384 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.477 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.426 ' HB2' HD22 ' B' ' 206' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -44.4 28.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -60.54 -36.55 78.71 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 127.535 2.334 . . . . 0.0 115.095 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -71.0 -19.65 62.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.434 1.494 . . . . 0.0 114.895 174.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -94.05 -74.61 0.53 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.392 1.077 . . . . 0.0 110.807 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.3 mt -121.0 132.21 54.77 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.91 1.284 . . . . 0.0 109.076 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . 0.266 10.2 p-80 -153.01 -73.79 0.13 Allowed 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.474 -1.391 . . . . 0.0 111.3 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 t -120.83 -56.15 1.96 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.079 0.952 . . . . 0.0 110.805 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -136.3 163.84 29.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.404 1.482 . . . . 0.0 107.71 -172.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.93 83.54 0.6 Allowed Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 125.025 1.298 . . . . 0.0 114.193 175.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -66.19 175.3 1.32 Allowed Pre-proline 0 N--CA 1.429 -1.485 0 C-N-CA 127.474 2.31 . . . . 0.0 113.159 163.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.44 123.37 11.97 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 122.547 2.165 . . . . 0.0 111.837 164.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.46 135.57 42.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.983 1.313 . . . . 0.0 110.855 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 53.2 mmm-85 -130.81 -114.63 0.24 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.21 119.26 0.22 Allowed Glycine 0 N--CA 1.431 -1.69 0 CA-C-O 123.19 1.439 . . . . 0.0 112.531 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -152.6 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.22 1.485 . . . . 0.0 113.207 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m -94.44 140.89 29.23 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.324 1.45 . . . . 0.0 111.338 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' H ' HD11 ' A' ' 65' ' ' LEU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -49.32 -32.19 10.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -109.23 -39.71 5.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.609 1.164 . . . . 0.0 111.071 166.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 39.1 mt -83.79 131.75 50.93 Favored Pre-proline 0 N--CA 1.43 -1.426 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -164.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -67.53 118.17 5.39 Favored 'Trans proline' 0 C--N 1.299 -2.049 0 CA-C-N 123.451 2.268 . . . . 0.0 114.622 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -75.63 -71.85 0.35 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.868 1.267 . . . . 0.0 111.703 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -134.73 -32.98 0.97 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.849 1.26 . . . . 0.0 109.905 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.266 9.3 ttpt 78.06 78.51 0.07 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.809 2.444 . . . . 0.0 111.525 175.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 . . . . . 0 C--O 1.26 1.624 0 C-N-CA 127.24 2.216 . . . . 0.0 111.129 -173.679 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 121.533 0.683 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.6 mtp180 -124.56 -177.18 3.73 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.3 mmm -83.4 -135.72 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.408 -1.433 . . . . 0.0 110.682 168.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 79.36 165.67 0.19 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.422 2.289 . . . . 0.0 110.945 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.426 HD22 ' HB2' ' A' ' 35' ' ' LEU . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.36 -28.58 68.3 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.87 -39.85 90.76 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.897 1.679 . . . . 0.0 113.332 170.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -77.23 -41.79 39.85 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.889 1.276 . . . . 0.0 110.992 -178.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.0 -30.63 70.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 126.408 1.883 . . . . 0.0 115.194 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -43.85 -31.53 0.87 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 129.326 3.051 . . . . 0.0 118.018 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.91 -31.89 65.36 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 37.4 m170 . . . . . 0 C--O 1.26 1.634 0 C-N-CA 125.912 1.685 . . . . 0.0 114.159 -179.908 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 . . . . . 0 CA--C 1.49 -1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -159.58 129.51 5.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.832 -1.167 . . . . 0.0 110.631 170.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -128.76 104.51 7.67 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.146 -0.972 . . . . 0.0 110.484 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 m 50.55 91.4 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.03 -52.59 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.132 1.773 . . . . 0.0 109.832 -176.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.435 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.435 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.461 HG21 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.405 ' HB2' HD22 ' B' ' 206' ' ' LEU . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -67.25 -19.59 65.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -39.26 -39.84 0.68 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 129.51 3.124 . . . . 0.0 117.413 178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -49.57 -35.79 21.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.275 2.63 . . . . 0.0 115.895 169.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 73.93 -1.18 3.14 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 127.269 2.227 . . . . 0.0 116.026 169.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.51 48.86 17.89 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.958 2.103 . . . . 0.0 114.002 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -104.62 -50.43 3.3 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.865 1.266 . . . . 0.0 110.594 -172.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -92.81 170.34 9.77 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.121 -0.987 . . . . 0.0 110.024 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -129.23 134.11 47.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.042 1.337 . . . . 0.0 108.19 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.84 -90.7 0.08 OUTLIER Glycine 0 N--CA 1.43 -1.751 0 O-C-N 120.361 -1.462 . . . . 0.0 113.278 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -113.74 155.77 44.61 Favored Pre-proline 0 N--CA 1.43 -1.442 0 O-C-N 121.587 -0.949 . . . . 0.0 111.667 -172.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -71.5 114.89 4.08 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 123.451 2.768 . . . . 0.0 112.001 164.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.83 148.14 25.94 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.272 45.5 mtp180 71.75 -45.48 0.62 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.057 2.543 . . . . 0.0 116.978 169.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.82 20.83 26.2 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 125.397 1.475 . . . . 0.0 114.026 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 49.61 -142.71 0.58 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.113 2.634 . . . . 0.0 118.113 149.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p -107.16 142.69 36.46 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 166.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.461 ' HB3' HG21 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -43.57 -42.99 5.36 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -106.48 -45.77 4.18 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.871 1.268 . . . . 0.0 110.964 175.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.4 mt -75.59 158.45 83.14 Favored Pre-proline 0 N--CA 1.43 -1.464 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -161.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.73 106.66 1.88 Allowed 'Trans proline' 0 C--N 1.3 -2.011 0 C-N-CA 122.563 2.175 . . . . 0.0 112.426 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -55.85 23.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.863 2.065 . . . . 0.0 113.491 -175.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.12 -73.39 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 103.778 -2.675 . . . . 0.0 103.778 168.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -165.51 20.33 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? . . . . . 0 C--O 1.259 1.599 0 O-C-N 120.383 -1.448 . . . . 0.0 111.137 170.984 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -105.98 -162.08 0.84 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.414 -1.429 . . . . 0.0 110.329 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.4 mtt -101.75 151.15 22.39 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.806 -1.184 . . . . 0.0 112.772 -177.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -154.42 -178.2 6.99 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.529 2.732 . . . . 0.0 103.708 166.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.405 HD22 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -58.25 -39.35 78.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -61.06 -45.62 94.0 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.693 1.197 . . . . 0.0 113.898 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -69.52 -37.72 77.27 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.5 1.12 . . . . 0.0 112.345 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.39 -44.93 84.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.4 1.88 . . . . 0.0 112.771 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.3 -30.26 71.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -76.65 -46.59 25.22 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.034 0.934 . . . . 0.0 112.759 173.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.252 10.8 m-70 . . . . . 0 C--O 1.259 1.596 0 C-N-CA 129.068 2.947 . . . . 0.0 112.952 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 119.884 -0.103 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.9 p -148.28 122.91 9.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.77 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -123.97 -60.74 1.42 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.837 -1.164 . . . . 0.0 110.393 169.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.8 m -125.58 35.29 4.75 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 122.982 1.372 . . . . 0.0 112.612 -163.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.59 -49.76 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 126.071 1.749 . . . . 0.0 112.633 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER -71.92 -17.69 62.07 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -51.27 -29.95 16.29 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 128.157 2.583 . . . . 0.0 115.468 170.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -59.9 -30.73 69.22 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.465 1.506 . . . . 0.0 114.67 169.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -91.23 -72.58 0.57 Allowed 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.713 -1.242 . . . . 0.0 111.743 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.6 mt 45.17 -104.83 0.09 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.662 1.985 . . . . 0.0 115.35 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -93.39 9.92 34.4 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.832 1.653 . . . . 0.0 113.872 -172.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.5 p -112.49 146.56 38.25 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.946 1.831 . . . . 0.0 113.535 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -116.94 166.93 11.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.855 2.062 . . . . 0.0 106.638 165.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.92 -29.75 4.52 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.351 -1.468 . . . . 0.0 115.635 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.94 157.4 30.73 Favored Pre-proline 0 N--CA 1.429 -1.495 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -176.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -61.89 130.13 29.99 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 122.76 2.307 . . . . 0.0 114.846 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -85.84 127.43 34.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.897 0.856 . . . . 0.0 110.307 177.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -131.59 -87.03 0.48 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.026 0.931 . . . . 0.0 108.767 174.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.4 62.75 1.32 Allowed Glycine 0 N--CA 1.43 -1.74 0 O-C-N 121.201 -0.937 . . . . 0.0 113.033 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.293 21.0 ptt? 43.43 -123.35 0.79 Allowed 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 165.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m -108.15 122.85 47.75 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 148.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -59.1 -46.79 87.4 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.76 -50.13 22.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.099 1.36 . . . . 0.0 111.136 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.9 152.83 69.42 Favored Pre-proline 0 N--CA 1.431 -1.41 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -161.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.91 106.45 2.14 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 C-N-CA 122.51 2.14 . . . . 0.0 113.33 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -79.62 -70.69 0.49 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -154.41 -84.89 0.06 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -169.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -158.63 74.29 0.67 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.852 0.861 . . . . 0.0 109.409 161.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER . . . . . 0 C--O 1.259 1.601 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 167.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 CA--C 1.489 -1.372 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -122.3 143.05 49.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.587 -1.321 . . . . 0.0 108.324 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.1 ptp -80.14 72.4 6.94 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.49 -1.381 . . . . 0.0 113.246 166.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -69.31 147.67 50.82 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 119.242 -2.161 . . . . 0.0 108.656 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -73.22 -29.05 62.53 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -76.14 -38.19 57.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.08 -1.012 . . . . 0.0 112.926 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.58 -37.61 84.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.095 -1.003 . . . . 0.0 113.004 175.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.9 -47.92 70.28 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.685 1.994 . . . . 0.0 112.063 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.89 -42.79 99.9 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.031 1.332 . . . . 0.0 114.442 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -75.95 -29.23 58.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -176.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.258 2.0 p-80 . . . . . 0 C--O 1.26 1.652 0 C-N-CA 127.083 2.153 . . . . 0.0 115.405 -177.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.354 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 p -143.77 151.61 40.2 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.628 . . . . 0.0 114.97 170.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -121.04 -59.75 1.7 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.577 1.951 . . . . 0.0 109.585 -173.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.8 m -90.24 76.1 6.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.513 -1.367 . . . . 0.0 111.919 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.54 -52.5 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 C-N-CA 126.528 1.931 . . . . 0.0 109.94 -172.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.406 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.406 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -18.37 60.65 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -52.51 -32.22 39.22 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.087 2.155 . . . . 0.0 114.172 172.657 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -64.87 -21.95 66.9 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.082 1.353 . . . . 0.0 114.548 178.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -80.78 -20.76 41.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.414 1.486 . . . . 0.0 112.812 177.023 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.0 mt -92.12 11.27 26.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.901 -1.749 . . . . 0.0 113.444 -173.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -89.57 -64.41 1.14 Allowed 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.951 -1.093 . . . . 0.0 113.049 -170.235 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -158.47 159.14 35.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.19 -0.944 . . . . 0.0 111.018 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -114.32 108.61 17.14 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.693 -1.254 . . . . 0.0 111.793 -167.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.87 -37.19 0.82 Allowed Glycine 0 N--CA 1.43 -1.743 0 O-C-N 121.179 -0.95 . . . . 0.0 113.984 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -103.25 163.49 17.37 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.92 177.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -62.2 136.0 57.73 Favored 'Trans proline' 0 C--N 1.3 -1.997 0 C-N-CA 122.498 2.132 . . . . 0.0 114.554 176.153 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -65.79 -45.37 82.68 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -174.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 66.39 94.27 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.801 2.04 . . . . 0.0 113.543 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.54 68.4 0.4 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.308 5.8 ptt? 43.19 -140.38 0.18 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.398 2.279 . . . . 0.0 115.93 170.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p -102.78 139.66 38.07 Favored 'General case' 0 N--CA 1.432 -1.373 0 O-C-N 120.673 -1.267 . . . . 0.0 110.064 163.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.407 HD13 ' H ' ' A' ' 65' ' ' LEU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -49.27 -36.26 20.11 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -97.21 -49.05 5.11 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.21 -0.931 . . . . 0.0 109.51 168.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 mt -77.97 130.23 73.45 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -153.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -71.65 116.23 4.62 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.905 2.403 . . . . 0.0 115.033 171.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -74.25 -60.82 2.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 118.794 0.724 . . . . 0.0 111.937 170.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -125.4 -40.3 2.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.252 1.021 . . . . 0.0 109.986 -170.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.0 tptp 70.05 62.01 0.24 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 128.405 2.682 . . . . 0.0 112.875 -178.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 C--O 1.26 1.633 0 C-N-CA 126.317 1.847 . . . . 0.0 110.555 -179.52 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.49 -1.365 0 CA-C-O 120.795 0.331 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -125.12 107.54 10.88 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.05 -1.031 . . . . 0.0 110.216 174.023 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.261 34.1 mtp 71.23 128.64 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 127.554 2.342 . . . . 0.0 113.214 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -164.57 168.01 18.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 -174.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.434 HD13 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -55.4 -34.55 64.48 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -64.34 -33.08 75.01 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.447 -1.408 . . . . 0.0 114.262 174.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -77.18 -50.0 13.93 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.985 -1.072 . . . . 0.0 110.032 175.377 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -47.84 -24.59 1.03 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 129.525 3.13 . . . . 0.0 116.53 -179.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -47.79 -28.59 2.61 Favored 'General case' 0 N--CA 1.428 -1.529 0 C-N-CA 127.337 2.255 . . . . 0.0 116.505 169.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -63.64 -32.34 73.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.304 -1.498 . . . . 0.0 113.858 173.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.257 99.8 m-70 . . . . . 0 C--O 1.261 1.673 0 C-N-CA 129.38 3.072 . . . . 0.0 117.197 178.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.491 -1.326 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.267 50.1 m 77.86 116.84 0.06 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.263 2.225 . . . . 0.0 113.054 177.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -96.56 -36.42 10.76 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.732 1.213 . . . . 0.0 110.751 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 m 64.09 59.86 1.04 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.466 1.906 . . . . 0.0 112.959 -177.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t -66.0 -59.16 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 127.277 2.231 . . . . 0.0 111.76 -167.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.453 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.453 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HB2' HD21 ' B' ' 206' ' ' LEU . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -64.59 -27.21 68.79 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.26 -39.16 72.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.729 2.012 . . . . 0.0 115.304 174.599 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -72.57 -22.96 60.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.029 -1.669 . . . . 0.0 114.706 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -70.06 -10.37 58.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 -168.296 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.2 mt -79.86 -125.03 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.373 -2.08 . . . . 0.0 112.826 174.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -95.16 1.6 54.84 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.451 -2.656 . . . . 0.0 116.364 -174.015 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -63.24 146.34 53.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 121.451 1.932 . . . . 0.0 116.003 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.439 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -102.21 -170.07 1.76 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.63 1.972 . . . . 0.0 112.023 -166.536 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 112.04 -89.36 0.53 Allowed Glycine 0 N--CA 1.429 -1.77 0 O-C-N 120.641 -1.287 . . . . 0.0 112.164 174.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.4 ptt85 -123.76 169.89 9.55 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 121.166 -1.196 . . . . 0.0 109.379 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.96 172.84 15.56 Favored 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 123.181 2.172 . . . . 0.0 112.644 166.648 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . 0.26 29.5 t80 82.37 128.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.178 2.191 . . . . 0.0 114.899 175.003 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -127.56 -76.03 0.57 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.552 1.541 . . . . 0.0 110.083 -173.07 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.16 106.73 2.2 Favored Glycine 0 N--CA 1.429 -1.786 0 C-N-CA 125.476 1.513 . . . . 0.0 113.579 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -61.74 -143.73 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.327 3.851 . . . . 0.0 114.235 175.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m -80.25 124.06 28.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.008 -1.682 . . . . 0.0 110.8 168.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -75.55 -21.69 57.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -93.03 -8.87 41.69 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.843 1.257 . . . . 0.0 109.605 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt -115.17 80.64 7.35 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.818 -1.176 . . . . 0.0 112.08 177.447 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.57 170.2 20.83 Favored 'Trans proline' 0 N--CA 1.434 -2.018 0 C-N-CA 123.445 2.764 . . . . 0.0 112.467 -175.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -86.19 -74.09 0.43 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.728 -0.607 . . . . 0.0 111.735 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.96 -27.44 0.15 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.11 -0.994 . . . . 0.0 112.045 -179.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt 81.53 40.1 0.05 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.231 2.612 . . . . 0.0 111.618 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 . . . . . 0 C--O 1.259 1.598 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.235 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 121.494 0.664 . . . . 0.0 112.595 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 -140.08 -176.66 4.68 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 105.236 -2.135 . . . . 0.0 105.236 174.531 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.58 79.82 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -138.0 173.01 12.08 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.186 1.794 . . . . 0.0 107.901 174.085 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.414 HD21 ' HB2' ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -64.15 -28.32 69.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -64.58 -26.33 68.36 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.868 -1.77 . . . . 0.0 113.775 177.196 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 14.6 ttp85 -71.36 -20.61 62.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.432 1.641 . . . . 0.0 115.432 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -72.66 -43.84 62.64 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.921 -1.737 . . . . 0.0 110.626 170.357 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.27 -20.1 51.45 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.823 2.049 . . . . 0.0 115.985 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -66.35 -20.84 66.19 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 126.037 1.735 . . . . 0.0 115.479 172.797 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.26 1.636 0 O-C-N 120.273 -1.517 . . . . 0.0 114.14 175.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 p -162.08 159.88 26.72 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.1 t70 72.35 -42.99 0.55 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.112 2.165 . . . . 0.0 114.424 -176.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.9 m -83.94 77.67 9.87 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.216 -1.552 . . . . 0.0 113.955 -177.503 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t -72.04 -47.77 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 128.349 2.659 . . . . 0.0 111.623 -179.149 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.405 ' O ' HG12 ' A' ' 11' ' ' ILE . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.418 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.418 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -16.74 61.66 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -51.68 -35.66 43.49 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 128.398 2.679 . . . . 0.0 115.556 173.448 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -76.15 -22.47 55.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.623 -1.298 . . . . 0.0 113.462 177.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -95.85 -60.71 1.58 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.097 1.359 . . . . 0.0 111.982 -167.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt 46.33 -125.93 1.42 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.471 2.308 . . . . 0.0 115.246 -179.036 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -107.66 50.59 0.77 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.132 -1.605 . . . . 0.0 110.274 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.315 50.8 p 55.7 76.31 0.28 Allowed 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.064 2.146 . . . . 0.0 113.876 -175.407 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.1 -37.29 61.56 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.087 -1.008 . . . . 0.0 110.926 -178.2 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -135.63 -57.58 0.06 OUTLIER Glycine 0 N--CA 1.429 -1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 111.669 170.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.7 ptt-85 -111.5 146.33 34.43 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 124.91 1.284 . . . . 0.0 111.292 -174.054 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -71.78 145.38 45.87 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.966 2.444 . . . . 0.0 112.983 165.009 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.2 t80 57.85 -138.33 0.88 Allowed 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.77 1.628 . . . . 0.0 114.011 176.279 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.25 23.8 mmm180 68.0 96.83 0.06 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.86 2.464 . . . . 0.0 115.268 178.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.85 82.43 0.34 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.781 -1.824 . . . . 0.0 109.754 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.416 ' HE3' ' HB ' ' A' ' 58' ' ' VAL . 19.4 ptt? 29.67 -119.17 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 129.23 3.012 . . . . 0.0 116.781 172.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m -105.4 122.33 45.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.997 1.319 . . . . 0.0 108.742 160.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.416 ' HB ' ' HE3' ' A' ' 53' ' ' MET . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.2 -37.17 86.18 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -84.13 -45.43 13.0 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.38 -1.45 . . . . 0.0 111.407 165.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.6 mt -77.08 166.74 42.33 Favored Pre-proline 0 N--CA 1.432 -1.362 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 -162.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -67.52 138.6 46.37 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.126 1.884 . . . . 0.0 114.287 172.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.68 -53.41 10.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.459 -0.776 . . . . 0.0 112.211 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.64 -56.37 0.13 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 175.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -164.2 82.78 0.42 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.0 1.381 . . . . 0.0 109.26 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 . . . . . 0 C--O 1.26 1.619 0 C-N-CA 127.198 2.199 . . . . 0.0 115.933 172.111 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 CA--C 1.49 -1.34 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -178.77 5.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.693 -1.88 . . . . 0.0 110.269 172.487 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 70.3 mtp -80.66 -116.08 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.065 -1.022 . . . . 0.0 110.413 174.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 78.55 155.86 0.16 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.747 2.019 . . . . 0.0 111.927 179.262 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -62.79 -26.86 68.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -56.55 -46.76 80.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 171.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -74.36 -35.27 63.54 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 123.76 0.824 . . . . 0.0 112.271 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -70.93 -25.74 62.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.163 -1.586 . . . . 0.0 114.72 176.002 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.97 -24.12 64.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.177 -1.577 . . . . 0.0 113.876 173.487 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -67.24 -51.91 47.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.624 1.17 . . . . 0.0 110.445 174.454 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t60 . . . . . 0 C--O 1.26 1.646 0 C-N-CA 126.082 1.753 . . . . 0.0 115.295 159.419 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 t 84.49 138.4 0.06 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.386 2.275 . . . . 0.0 112.516 168.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -93.8 -20.0 20.5 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.369 -0.832 . . . . 0.0 110.812 -178.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.5 m -85.66 67.73 10.17 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 124.148 1.928 . . . . 0.0 112.319 178.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t -75.16 -49.82 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 128.045 2.538 . . . . 0.0 110.216 -175.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.413 ' O ' HG12 ' A' ' 11' ' ' ILE . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.436 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.452 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -22.74 57.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -47.28 -26.28 1.19 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 129.124 2.97 . . . . 0.0 116.812 164.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.91 -47.56 67.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.4 2.28 . . . . 0.0 115.898 167.478 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 66.31 4.11 3.06 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 58.8 mt 59.22 89.09 0.06 Allowed 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 129.037 2.935 . . . . 0.0 116.389 175.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -88.68 49.81 1.85 Allowed 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.74 -1.85 . . . . 0.0 112.9 -179.265 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.4 t -110.04 -170.54 1.67 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.511 1.524 . . . . 0.0 108.24 174.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -74.23 -57.5 3.91 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.881 -1.762 . . . . 0.0 110.726 176.653 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 175.85 32.99 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.709 0 O-C-N 121.473 -0.767 . . . . 0.0 114.707 170.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -100.84 163.84 17.28 Favored Pre-proline 0 N--CA 1.43 -1.447 0 CA-C-N 118.558 1.179 . . . . 0.0 110.533 177.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -66.65 150.74 83.65 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 CA-C-N 122.315 1.863 . . . . 0.0 113.5 171.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.65 -156.52 0.68 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 124.983 1.313 . . . . 0.0 107.878 -175.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -94.66 -132.41 0.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 161.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.41 71.59 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 105.254 -3.139 . . . . 0.0 105.254 -173.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.381 0.0 OUTLIER 47.69 -134.78 1.09 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.075 1.75 . . . . 0.0 113.178 -161.762 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m -79.76 110.19 14.88 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 159.515 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HB3' HG23 ' A' ' 27' ' ' ILE . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -46.17 -46.47 17.36 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -90.0 -47.51 7.8 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.788 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -80.81 168.92 21.75 Favored Pre-proline 0 N--CA 1.429 -1.487 0 N-CA-C 116.449 2.018 . . . . 0.0 116.449 -161.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -63.3 164.42 20.23 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 CA-C-N 123.556 2.306 . . . . 0.0 117.341 -177.341 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 40.39 84.64 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.911 2.884 . . . . 0.0 117.801 -174.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.61 82.19 0.45 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -70.56 -48.16 56.74 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.261 1.668 0 C-N-CA 124.536 1.135 . . . . 0.0 110.782 171.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 120.848 0.356 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -123.13 59.43 1.08 Allowed 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.646 1.579 . . . . 0.0 107.796 174.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.7 mtp 67.08 152.74 0.08 Allowed 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.389 2.676 . . . . 0.0 116.103 -171.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -174.96 -178.21 1.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.431 2.292 . . . . 0.0 104.963 178.445 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -72.67 -29.0 63.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -61.72 -38.62 88.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.54 1.536 . . . . 0.0 114.302 176.447 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -73.91 -35.41 64.63 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.808 -1.182 . . . . 0.0 113.021 174.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.41 -29.2 69.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.179 1.391 . . . . 0.0 114.7 175.292 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -52.13 -21.15 3.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.322 2.649 . . . . 0.0 117.852 -175.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -66.31 -21.58 66.26 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.32 1.448 . . . . 0.0 113.567 175.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 120.934 -1.103 . . . . 0.0 108.94 174.682 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 . . . . . 0 CA--C 1.491 -1.32 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m 118.84 167.4 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 131.395 3.878 . . . . 0.0 110.486 173.345 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -82.82 -46.52 12.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.879 -1.138 . . . . 0.0 109.315 164.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 p -84.23 74.38 10.32 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.875 1.67 . . . . 0.0 113.451 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t -80.52 -61.72 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.02 1.728 . . . . 0.0 110.733 -176.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.422 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.408 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.1 m-70 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.437 ' HB2' HG22 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -59.17 -33.08 70.5 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -45.53 -36.0 4.29 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 129.235 3.014 . . . . 0.0 116.985 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -61.83 -31.53 71.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.309 -1.494 . . . . 0.0 115.02 -178.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.18 -32.23 55.97 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.794 1.237 . . . . 0.0 112.424 -167.108 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -84.19 84.64 7.54 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.263 1.825 . . . . 0.0 111.695 -172.367 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.6 m170 -85.71 58.53 5.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.437 -2.04 . . . . 0.0 113.925 -167.538 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.5 t -85.41 159.69 19.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.639 -1.288 . . . . 0.0 112.142 179.552 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -88.99 132.25 34.81 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.133 -1.604 . . . . 0.0 110.254 179.947 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 165.19 -67.9 0.2 Allowed Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -173.31 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -131.34 161.23 63.2 Favored Pre-proline 0 N--CA 1.43 -1.467 0 C-N-CA 125.434 1.494 . . . . 0.0 109.457 177.273 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.71 160.05 41.5 Favored 'Trans proline' 0 C--N 1.301 -1.97 0 C-N-CA 122.749 2.299 . . . . 0.0 112.001 168.886 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -115.9 160.84 19.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.609 1.195 . . . . 0.0 112.604 -173.484 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -106.27 -120.09 0.23 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 123.924 0.89 . . . . 0.0 109.792 176.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.95 163.85 32.43 Favored Glycine 0 N--CA 1.429 -1.769 0 O-C-N 121.01 -1.056 . . . . 0.0 113.317 -170.457 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.415 ' HE2' ' HB ' ' A' ' 58' ' ' VAL . 7.8 ptt? -156.9 -155.54 0.54 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.865 1.266 . . . . 0.0 111.076 -165.259 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m -110.12 149.65 29.74 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 121.303 -0.873 . . . . 0.0 110.248 174.269 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.437 HG22 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.408 ' HB3' HG21 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -75.61 -22.24 57.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -79.82 -33.29 40.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.85 1.66 . . . . 0.0 110.969 179.088 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.8 mt -78.2 146.67 71.39 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 123.552 0.741 . . . . 0.0 112.66 177.541 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -73.7 174.6 12.0 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 C-N-CA 123.155 2.57 . . . . 0.0 113.18 -175.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.15 -50.56 15.92 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -179.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.78 -44.63 0.1 Allowed 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.77 -1.206 . . . . 0.0 109.493 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.286 31.2 tttt 84.57 38.33 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.901 2.48 . . . . 0.0 111.327 173.81 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.311 7.0 mpt_? . . . . . 0 C--O 1.259 1.556 0 N-CA-C 119.303 3.075 . . . . 0.0 119.303 177.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.259 13.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.204 1.478 . . . . 0.0 113.463 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -135.56 47.02 2.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.941 -2.349 . . . . 0.0 113.074 -177.627 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 42.1 mtt -80.24 161.11 25.33 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.881 -1.762 . . . . 0.0 113.524 174.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -176.26 -170.5 0.36 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 160.298 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -62.23 -30.35 71.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.55 -51.18 64.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.908 -1.12 . . . . 0.0 113.853 171.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -70.28 -36.41 74.37 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.184 1.394 . . . . 0.0 114.166 -178.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.98 -36.1 62.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.753 2.021 . . . . 0.0 115.364 177.231 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.32 -20.7 65.72 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.88 -18.77 60.87 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.016 1.326 . . . . 0.0 113.28 173.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 . . . . . 0 C--O 1.261 1.677 0 C-N-CA 131.164 3.786 . . . . 0.0 120.741 171.392 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.49 -1.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m 70.2 118.02 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.853 2.461 . . . . 0.0 115.402 172.596 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -95.46 -27.79 15.23 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.232 -1.542 . . . . 0.0 112.89 -173.512 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.286 67.2 m 83.4 59.64 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.901 2.48 . . . . 0.0 111.869 -173.414 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t -79.77 -51.32 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 127.697 2.399 . . . . 0.0 111.54 -178.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.428 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.428 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD22 ' B' ' 206' ' ' LEU . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -22.05 66.64 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -52.65 -53.92 40.48 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.068 2.147 . . . . 0.0 114.636 167.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -77.11 -16.63 59.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.794 -1.191 . . . . 0.0 113.363 -178.058 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -69.24 -46.26 67.79 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.145 -1.597 . . . . 0.0 113.113 168.105 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -73.92 -45.87 47.89 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.764 -1.21 . . . . 0.0 113.841 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.15 87.35 2.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.431 -1.418 . . . . 0.0 109.495 173.842 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -89.2 143.98 26.45 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 122.234 1.016 . . . . 0.0 110.142 179.119 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -99.59 14.34 30.34 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.936 1.294 . . . . 0.0 110.346 174.865 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -155.56 -111.94 0.4 Allowed Glycine 0 N--CA 1.43 -1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 111.504 173.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -101.04 165.57 13.96 Favored Pre-proline 0 N--CA 1.431 -1.419 0 O-C-N 120.918 -1.342 . . . . 0.0 109.525 -178.38 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -66.43 113.46 2.7 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 CA-C-N 122.461 1.915 . . . . 0.0 111.574 163.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -99.48 -163.26 1.02 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.901 0.88 . . . . 0.0 108.899 -178.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -93.13 -111.99 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 160.816 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.51 124.33 1.3 Allowed Glycine 0 N--CA 1.43 -1.716 0 O-C-N 120.017 -1.677 . . . . 0.0 110.354 172.456 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.285 13.1 ptt? 44.76 -113.16 0.33 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 157.125 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m -120.37 122.1 40.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.939 1.296 . . . . 0.0 110.248 152.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.539 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.539 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -59.54 -32.15 70.06 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -89.05 -21.86 23.24 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 125.204 1.402 . . . . 0.0 112.703 -177.773 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.9 mt -100.82 156.46 35.14 Favored Pre-proline 0 N--CA 1.428 -1.528 0 O-C-N 120.142 -1.599 . . . . 0.0 112.47 -171.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -75.79 169.44 22.23 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 122.398 2.065 . . . . 0.0 111.115 169.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -72.88 -77.49 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.743 0.782 . . . . 0.0 111.91 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.5 -120.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.18 -2.526 . . . . 0.0 104.18 177.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.07 58.57 1.29 Allowed 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.819 1.295 . . . . 0.0 110.55 162.944 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? . . . . . 0 C--O 1.26 1.635 0 C-N-CA 125.308 1.443 . . . . 0.0 108.403 173.555 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -75.62 109.67 9.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.671 -1.893 . . . . 0.0 114.721 -172.049 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.276 2.5 ttt 57.23 69.08 0.77 Allowed 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 168.26 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -119.42 179.29 4.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.732 -1.23 . . . . 0.0 111.151 168.029 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -72.68 -24.61 61.04 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -58.57 -31.05 67.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.327 -1.483 . . . . 0.0 113.864 175.481 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -70.79 -41.48 71.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.79 2.436 . . . . 0.0 112.584 175.728 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.27 -22.93 47.55 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.11 -1.619 . . . . 0.0 113.258 -176.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -73.99 -19.76 60.55 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.904 -1.123 . . . . 0.0 113.397 166.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.59 -29.6 66.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.028 -1.67 . . . . 0.0 114.436 -179.172 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.259 1.58 0 N-CA-C 118.722 2.86 . . . . 0.0 118.722 160.516 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.26 69.4 m 83.59 96.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.217 2.607 . . . . 0.0 111.399 178.268 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -83.67 -69.93 0.6 Allowed 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.409 -0.807 . . . . 0.0 110.421 -176.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -101.01 101.41 12.18 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.231 1.967 . . . . 0.0 112.219 175.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t -75.03 -44.6 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 C-N-CA 127.346 2.258 . . . . 0.0 109.012 176.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.446 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.415 HG22 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.46 HG21 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.424 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -56.23 6.17 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -55.1 -45.33 75.46 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.219 2.208 . . . . 0.0 113.435 -174.352 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -71.31 -20.54 62.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.635 1.974 . . . . 0.0 112.679 179.778 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -90.32 -1.68 57.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.764 -1.21 . . . . 0.0 112.906 179.08 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.23 -173.33 3.95 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.183 -1.573 . . . . 0.0 112.334 176.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -77.66 83.02 4.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.296 -1.503 . . . . 0.0 111.09 177.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.3 p -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.586 -1.322 . . . . 0.0 111.238 179.3 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.6 tttt -106.41 -29.89 9.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.971 0.908 . . . . 0.0 112.211 -163.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.05 -77.15 1.0 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 124.931 1.253 . . . . 0.0 111.467 176.073 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -68.75 158.11 86.71 Favored Pre-proline 0 N--CA 1.43 -1.463 0 C-N-CA 124.767 1.227 . . . . 0.0 113.317 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.84 154.1 58.67 Favored 'Trans proline' 0 N--CA 1.434 -2.002 0 CA-C-N 122.841 2.05 . . . . 0.0 112.625 176.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -79.2 162.41 25.75 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.544 1.164 . . . . 0.0 111.824 -177.581 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 68.4 mtm180 -139.23 -116.88 0.14 Allowed 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.472 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.48 93.94 0.87 Allowed Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 108.204 -1.958 . . . . 0.0 108.204 -167.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -149.94 0.07 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -178.568 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -96.34 147.24 24.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 -173.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HB3' HG21 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -63.57 -35.76 81.55 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -132.02 22.03 4.52 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.337 0.655 . . . . 0.0 111.019 -176.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.297 19.8 mt -69.75 -87.93 0.02 OUTLIER Pre-proline 0 N--CA 1.43 -1.457 0 CA-C-O 115.921 -1.99 . . . . 0.0 114.781 161.376 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.13 151.93 55.86 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 CA-C-N 126.86 3.486 . . . . 0.0 113.402 -170.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -87.72 -36.17 17.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.783 1.233 . . . . 0.0 113.248 -169.479 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.6 -59.63 0.23 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -174.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -142.93 -44.74 0.3 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 168.123 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 . . . . . 0 C--O 1.26 1.655 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.371 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 CA--C 1.49 -1.35 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -105.83 145.8 30.73 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 109.142 173.086 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -70.0 140.16 52.87 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 121.159 -0.963 . . . . 0.0 113.35 174.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -174.48 -168.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 -172.947 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -53.58 -27.14 24.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -61.47 -33.44 73.77 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.264 1.426 . . . . 0.0 113.745 173.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -78.0 -26.68 48.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.178 1.391 . . . . 0.0 111.363 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -74.89 -35.1 62.28 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 119.715 -1.866 . . . . 0.0 112.083 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -71.06 -18.36 62.56 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.746 2.018 . . . . 0.0 114.172 175.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -68.76 -46.59 68.41 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.725 -1.235 . . . . 0.0 111.809 179.619 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.265 57.2 m80 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 127.578 2.351 . . . . 0.0 114.299 174.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 m -87.45 113.3 23.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.712 1.244 . . . . 0.0 114.266 -158.862 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -83.94 -31.9 25.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.591 2.756 . . . . 0.0 113.064 -178.471 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -83.88 40.14 0.73 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.094 1.887 . . . . 0.0 116.094 -169.337 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.28 -56.41 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 126.353 1.861 . . . . 0.0 112.494 -178.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.415 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -65.49 -30.43 71.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -60.29 -55.61 31.57 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.23 1.812 . . . . 0.0 112.672 172.661 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -58.81 -35.66 73.22 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.672 1.189 . . . . 0.0 114.163 178.406 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.34 -26.86 68.22 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.53 1.932 . . . . 0.0 115.146 174.657 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.3 mt -81.94 149.55 28.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.511 -1.993 . . . . 0.0 113.594 179.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 74.63 42.08 0.31 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.613 1.965 . . . . 0.0 113.536 169.381 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 p -80.12 163.59 24.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.09 -1.006 . . . . 0.0 111.224 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -76.94 -1.67 29.78 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.242 -1.536 . . . . 0.0 114.329 175.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.12 -63.57 0.28 Allowed Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.813 -1.18 . . . . 0.0 111.679 175.377 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 28.3 ptt-85 -72.26 155.88 91.08 Favored Pre-proline 0 N--CA 1.43 -1.458 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -170.935 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -74.51 112.95 3.67 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.63 2.22 . . . . 0.0 111.789 168.268 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.48 158.67 41.69 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 -178.707 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.317 87.5 mtt-85 85.65 126.87 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 124.764 2.221 . . . . 0.0 116.06 168.148 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 132.16 138.82 4.21 Favored Glycine 0 N--CA 1.43 -1.724 0 N-CA-C 104.357 -3.497 . . . . 0.0 104.357 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -161.58 0.4 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.116 -1.226 . . . . 0.0 110.14 174.571 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m -66.7 130.6 43.71 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.701 -1.874 . . . . 0.0 113.063 -175.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.1 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.28 -17.94 59.22 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -86.72 -7.29 58.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.029 1.332 . . . . 0.0 110.612 172.017 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 52.4 mt -112.06 175.1 2.0 Allowed Pre-proline 0 N--CA 1.431 -1.417 0 C-N-CA 124.873 1.269 . . . . 0.0 110.558 176.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -65.83 -63.68 0.06 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.973 0 C-N-CA 122.302 2.001 . . . . 0.0 114.709 167.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.95 -121.59 0.28 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.388 1.075 . . . . 0.0 110.627 -178.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -167.47 -36.19 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.272 -1.518 . . . . 0.0 111.461 -173.368 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.271 3.4 mptp? 79.52 -0.43 2.21 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.425 2.29 . . . . 0.0 114.945 -179.319 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.302 0.0 OUTLIER . . . . . 0 C--O 1.26 1.618 0 C-N-CA 128.028 2.531 . . . . 0.0 114.768 -177.478 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 CA--C 1.49 -1.328 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 34.5 mtm105 -141.45 166.92 23.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.247 -1.533 . . . . 0.0 112.603 -168.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 8.3 mmm -63.66 115.01 4.34 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.18 1.392 . . . . 0.0 113.867 178.248 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -127.8 174.73 8.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 170.248 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -70.38 -41.54 72.93 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -64.95 -41.24 95.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.651 1.18 . . . . 0.0 113.634 173.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -64.11 -36.89 85.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.532 -1.355 . . . . 0.0 113.808 177.567 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.87 -42.11 97.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 169.957 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.6 -20.25 65.5 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -71.08 -57.84 4.14 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.19 -0.944 . . . . 0.0 112.183 170.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 29.1 m170 . . . . . 0 C--O 1.26 1.628 0 C-N-CA 126.311 1.844 . . . . 0.0 114.424 -169.19 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 120.793 0.33 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 p -158.53 134.74 9.23 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.742 -1.224 . . . . 0.0 110.407 170.629 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -90.73 -47.68 7.5 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.279 -0.888 . . . . 0.0 110.133 169.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.4 m 68.78 66.98 0.3 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.838 1.78 . . . . 0.0 112.479 176.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -67.9 -51.4 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 129.262 3.025 . . . . 0.0 110.87 -175.125 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.446 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.446 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.4 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.412 ' HB2' ' HE3' ' A' ' 53' ' ' MET . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -19.52 65.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -45.3 -31.71 1.69 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.331 2.652 . . . . 0.0 115.823 166.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -44.02 33.99 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.444 2.298 . . . . 0.0 116.23 174.129 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -82.77 -30.73 28.73 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 121.975 0.893 . . . . 0.0 112.0 -177.852 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.1 mt -71.07 -25.52 62.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -172.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.25 -76.24 0.08 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.975 -1.078 . . . . 0.0 111.722 168.191 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -176.1 154.2 1.39 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.704 1.201 . . . . 0.0 108.165 -176.067 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -99.76 170.08 8.8 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.298 1.439 . . . . 0.0 111.225 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.43 -27.85 14.25 Favored Glycine 0 N--CA 1.429 -1.771 0 O-C-N 119.955 -1.716 . . . . 0.0 113.507 170.366 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -89.23 164.54 30.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 125.611 1.564 . . . . 0.0 111.789 -177.851 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -59.18 133.39 52.57 Favored 'Trans proline' 0 N--CA 1.433 -2.043 0 C-N-CA 123.241 2.628 . . . . 0.0 114.754 178.064 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 136.24 35.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.559 2.429 . . . . 0.0 117.559 -161.822 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.3 mmt-85 -99.82 -21.66 15.65 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.469 1.508 . . . . 0.0 111.615 176.265 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.09 50.78 3.11 Favored Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 115.896 1.118 . . . . 0.0 115.896 -178.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' MET . . . . . 0.412 ' HE3' ' HB2' ' A' ' 38' ' ' TYR . 23.6 ptt? 33.73 -137.28 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.513 3.525 . . . . 0.0 118.785 155.808 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m -106.25 131.49 53.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.487 1.115 . . . . 0.0 109.871 169.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -72.91 -23.97 60.77 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -81.57 -30.45 33.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.127 1.371 . . . . 0.0 110.772 179.133 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -84.43 150.02 56.22 Favored Pre-proline 0 N--CA 1.43 -1.454 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -177.637 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.68 147.67 25.05 Favored 'Trans proline' 0 C--N 1.299 -2.055 0 C-N-CA 122.418 2.079 . . . . 0.0 112.667 175.937 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -77.3 -46.11 24.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 176.372 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.52 -60.7 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 175.492 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -163.39 71.56 0.26 Allowed 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.176 0.989 . . . . 0.0 110.715 175.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.604 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -176.348 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.49 -1.345 0 CA-C-O 122.062 0.934 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 67.7 mtt-85 -142.82 -171.06 3.37 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.742 -1.849 . . . . 0.0 109.209 174.152 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.0 mtt -73.48 -107.4 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.605 -1.31 . . . . 0.0 112.44 167.008 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 71.7 178.21 0.25 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.792 2.437 . . . . 0.0 110.943 -168.995 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -53.27 -34.07 55.71 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -69.05 -29.91 68.15 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -80.08 -39.36 29.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.408 1.483 . . . . 0.0 110.252 172.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -58.1 -46.8 84.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.731 1.612 . . . . 0.0 114.895 176.559 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.74 -19.18 37.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.606 2.362 . . . . 0.0 116.795 179.503 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.79 -35.73 79.17 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.066 -1.021 . . . . 0.0 113.309 177.453 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 . . . . . 0 C--O 1.26 1.654 0 C-N-CA 124.445 1.098 . . . . 0.0 111.707 -174.447 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 CA--C 1.49 -1.355 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 74.64 139.76 0.06 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.389 2.276 . . . . 0.0 114.785 169.929 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.29 112.76 24.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.271 -1.518 . . . . 0.0 109.522 176.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -132.7 34.22 3.68 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.139 1.376 . . . . 0.0 109.855 -174.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t -56.72 -55.83 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 128.61 2.764 . . . . 0.0 112.264 -179.499 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.319 0.0 OUTLIER -77.6 -15.9 58.93 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -38.98 -39.46 0.54 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 129.806 3.242 . . . . 0.0 118.345 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.89 -28.39 16.01 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 128.366 2.667 . . . . 0.0 115.639 176.342 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -81.16 -21.7 39.55 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -60.66 -45.9 92.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -173.282 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.55 60.5 1.01 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.551 -1.343 . . . . 0.0 110.259 164.503 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.5 t -81.14 145.82 30.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.028 -1.045 . . . . 0.0 110.968 172.678 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -132.04 -110.8 0.24 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 178.241 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -101.82 31.59 8.5 Favored Glycine 0 N--CA 1.43 -1.723 0 O-C-N 120.745 -1.222 . . . . 0.0 113.313 -178.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -84.8 154.08 61.14 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 121.525 -0.985 . . . . 0.0 109.822 174.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.76 169.45 22.34 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 121.894 1.729 . . . . 0.0 111.05 161.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -72.84 135.69 45.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.046 0.927 . . . . 0.0 111.73 178.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -100.09 -104.83 0.23 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 123.769 0.828 . . . . 0.0 112.867 178.067 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.51 -155.33 53.37 Favored Glycine 0 N--CA 1.431 -1.668 0 O-C-N 119.769 -1.832 . . . . 0.0 111.531 -168.052 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -156.53 -138.55 0.07 Allowed 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.245 -1.15 . . . . 0.0 109.363 -164.772 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m -86.92 122.14 30.37 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 162.544 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -65.66 -29.31 69.85 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -83.33 -23.37 32.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.95 -1.094 . . . . 0.0 111.422 178.859 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -95.42 162.23 25.23 Favored Pre-proline 0 N--CA 1.43 -1.446 0 C-N-CA 124.074 0.949 . . . . 0.0 111.768 -177.276 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -72.43 162.37 41.66 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 CA-C-N 122.633 1.976 . . . . 0.0 114.186 -174.902 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -91.51 -39.11 12.12 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 121.371 -0.831 . . . . 0.0 111.795 164.013 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -151.05 -123.6 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -121.23 -82.48 0.65 Allowed 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 153.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.3 mtt-85 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 124.733 1.213 . . . . 0.0 110.024 171.318 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.26 14.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.283 1.516 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -85.9 162.34 18.63 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.605 -1.934 . . . . 0.0 111.637 178.154 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 34.8 mmm -75.3 75.78 2.41 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.57 -1.332 . . . . 0.0 113.709 176.816 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -111.37 176.07 5.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.218 1.407 . . . . 0.0 107.8 169.81 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -69.2 -28.08 66.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.64 -26.74 64.56 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.224 -1.548 . . . . 0.0 113.644 170.011 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -26.4 68.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.249 -1.532 . . . . 0.0 113.067 175.463 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.76 -36.28 80.22 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.014 -1.679 . . . . 0.0 113.452 170.332 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.88 -19.11 64.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.628 -1.295 . . . . 0.0 113.233 173.573 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -74.5 -17.75 60.71 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 177.678 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 . . . . . 0 C--O 1.26 1.607 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -177.375 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.422 HG12 ' H ' ' A' ' 27' ' ' ILE . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 122.169 0.985 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.462 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.462 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 72' ' ' LEU . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.473 ' HG3' HD13 ' A' ' 27' ' ' ILE . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.567 HD13 ' HB3' ' A' ' 61' ' ' GLU . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 62' ' ' VAL 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.567 ' HB3' HD13 ' A' ' 34' ' ' ILE . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.65 ' HA ' HD23 ' A' ' 65' ' ' LEU . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 62' ' ' VAL . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.413 HD13 HG12 ' A' ' 17' ' ' ILE . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.704 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t . . . . . 0 N--CA 1.43 -1.447 0 CA-C-O 122.791 1.281 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.474 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.474 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 . . . . . 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 215' ' ' ARG . . . . . 0.442 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 115.99 1.848 . . . . 0.0 115.99 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.433 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.43 -1.431 0 CA-C-O 122.3 1.048 . . . . 0.0 109.84 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 65' ' ' LEU 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.414 HG23 HD13 ' A' ' 35' ' ' LEU 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.43 -1.446 0 CA-C-O 122.785 1.279 . . . . 0.0 108.04 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE2' HD11 ' A' ' 17' ' ' ILE . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 14' ' ' VAL . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.426 HD11 ' CE2' ' A' ' 13' ' ' TYR . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 61' ' ' GLU . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.667 HD13 HG23 ' B' ' 202' ' ' ILE . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.873 0.844 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 34' ' ' ILE . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HA ' HD13 ' A' ' 65' ' ' LEU . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.731 0.777 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.667 HG23 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.431 -1.418 0 CA-C-O 122.374 1.083 . . . . 0.0 113.514 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.415 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.507 HD13 HG23 ' B' ' 202' ' ' ILE . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.547 ' HG2' HD23 ' B' ' 206' ' ' LEU 0.332 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.55 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.507 HG23 HD13 ' A' ' 35' ' ' LEU . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 39' ' ' GLN . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t . . . . . 0 N--CA 1.429 -1.485 0 CA-C-O 121.753 0.787 . . . . 0.0 112.848 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.445 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.534 HD13 HG23 ' B' ' 202' ' ' ILE . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.429 -1.487 0 CA-C-O 121.217 0.532 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.498 ' HA ' HD13 ' A' ' 65' ' ' LEU . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 . . . . . 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-O 121.631 0.729 . . . . 0.0 112.856 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.534 HG23 HD13 ' A' ' 35' ' ' LEU . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 N--CA 1.43 -1.449 0 CA-C-O 123.027 1.394 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.679 HG22 HG23 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.407 ' CE1' HD12 ' B' ' 206' ' ' LEU . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.43 -1.473 0 CA-C-O 122.135 0.969 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.679 HG23 HG22 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.542 ' O ' HD12 ' A' ' 65' ' ' LEU 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.451 HG21 HD21 ' A' ' 35' ' ' LEU . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.542 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 N--CA 1.429 -1.49 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.621 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 . . . . . 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.481 1.134 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.495 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' HD13 ' A' ' 27' ' ' ILE . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 121.8 0.81 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.49 ' HA ' HD13 ' A' ' 65' ' ' LEU . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.415 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 N--CA 1.431 -1.384 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.456 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.521 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 . . . . . 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.431 -1.421 0 CA-C-O 122.278 1.037 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.413 ' CE1' HD11 ' A' ' 11' ' ' ILE . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 7' ' ' PHE . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.533 HG23 HD23 ' A' ' 65' ' ' LEU . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.734 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.066 0.46 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 65' ' ' LEU . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.533 HD23 HG23 ' A' ' 27' ' ' ILE . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 . . . . . 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.579 HG23 HD13 ' A' ' 35' ' ' LEU . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.734 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t . . . . . 0 N--CA 1.43 -1.43 0 CA-C-O 123.201 1.476 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.419 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 N--CA 1.429 -1.494 0 CA-C-O 122.06 0.934 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 . . . . . 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.0 m80 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.647 1.213 . . . . 0.0 109.02 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 65' ' ' LEU . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 202' ' ' ILE . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.431 -1.408 0 CA-C-O 121.138 0.494 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.463 HD11 ' CZ ' ' A' ' 76' ' ' PHE 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 . . . . . 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t . . . . . 0 N--CA 1.429 -1.491 0 CA-C-O 123.448 1.594 . . . . 0.0 111.549 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HG3' HD13 ' A' ' 27' ' ' ILE . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.588 HD12 HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.431 -1.424 0 CA-C-O 122.726 1.251 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' HD13 ' A' ' 65' ' ' LEU . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 62' ' ' VAL . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.494 HG23 HD13 ' A' ' 35' ' ' LEU 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.588 HD21 HD12 ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 . . . . . 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.431 -1.425 0 CA-C-O 122.641 1.21 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.491 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 14' ' ' VAL . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.414 ' HG2' HD23 ' B' ' 206' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.429 -1.513 0 CA-C-O 121.025 0.441 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' HD12 ' A' ' 65' ' ' LEU . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.409 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 . . . . . 0 N--CA 1.431 -1.418 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 . . . . . 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t . . . . . 0 N--CA 1.43 -1.458 0 CA-C-O 122.342 1.067 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.517 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HG3' HD13 ' A' ' 27' ' ' ILE . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.512 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 61' ' ' GLU . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB2' HD11 ' B' ' 206' ' ' LEU . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? . . . . . 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.43 -1.45 0 CA-C-O 122.297 1.046 . . . . 0.0 109.164 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HB3' HD13 ' A' ' 34' ' ' ILE . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 65' ' ' LEU . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 . . . . . 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 123.198 1.475 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.439 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.681 HD13 HG23 ' B' ' 202' ' ' ILE . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.431 -1.409 0 CA-C-O 122.187 0.994 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 65' ' ' LEU . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.59 1.186 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 35' ' ' LEU . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 35' ' ' LEU . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 123.09 1.424 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.434 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.651 HD13 HG23 ' B' ' 202' ' ' ILE . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 121.936 0.874 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' HD23 ' A' ' 65' ' ' LEU . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 62' ' ' VAL . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 . . . . . 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.651 HG23 HD13 ' A' ' 35' ' ' LEU . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.438 HD21 HD12 ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.275 1.512 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.456 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.496 HG21 ' HB2' ' A' ' 61' ' ' GLU . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.447 HD11 HD22 ' B' ' 205' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.078 0.466 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HB2' HG21 ' A' ' 34' ' ' ILE . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.913 1.339 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 35' ' ' LEU 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.447 HD22 HD11 ' A' ' 35' ' ' LEU . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t . . . . . 0 N--CA 1.429 -1.489 0 CA-C-O 122.71 1.243 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.454 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.621 HD13 HG23 ' B' ' 202' ' ' ILE . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? . . . . . 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 65' ' ' LEU . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 . . . . . 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.429 -1.5 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.621 HG23 HD13 ' A' ' 35' ' ' LEU . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? . . . . . 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.057 1.408 . . . . 0.0 112.633 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.463 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 . . . . . 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 . . . . . 0 N--CA 1.431 -1.396 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.609 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 . . . . . 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.429 -1.51 0 CA-C-O 122.624 1.202 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 27' ' ' ILE . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.645 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.432 -1.373 0 CA-C-O 122.517 1.151 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 61' ' ' GLU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.431 -1.42 0 CA-C-O 122.055 0.931 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.482 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.445 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.563 HD13 HG23 ' B' ' 202' ' ' ILE . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.062 0.458 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.412 ' HA ' HD13 ' A' ' 65' ' ' LEU . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 . . . . . 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.462 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.563 HG23 HD13 ' A' ' 35' ' ' LEU . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 . . . . . 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 122.977 1.37 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.475 ' HA ' HD13 ' A' ' 65' ' ' LEU . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 62' ' ' VAL . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 121.638 0.732 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.65 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.19 0.995 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.466 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.457 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.608 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.507 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' A' ' 65' ' ' LEU . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 ' O ' ' A' ' 61' ' ' GLU . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 . . . . . 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.608 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 . . . . . 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 122.982 1.372 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.513 ' HB2' HG21 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? . . . . . 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.43 -1.444 0 CA-C-O 121.474 0.654 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 65' ' ' LEU 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CE1' HD11 ' B' ' 202' ' ' ILE . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.418 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.654 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 123.172 1.463 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.498 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.436 HG21 ' HB3' ' B' ' 208' ' ' ALA . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.442 HG21 ' HB2' ' A' ' 61' ' ' GLU . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.67 HD13 HG23 ' B' ' 202' ' ' ILE . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.882 0.849 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HB2' HG21 ' A' ' 34' ' ' ILE . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.566 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 73' ' ' LEU . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 . . . . . 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 121.697 0.76 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.67 HG23 HD13 ' A' ' 35' ' ' LEU . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 208' ' ' ALA . . . . . 0.436 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 . . . . . 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t . . . . . 0 N--CA 1.431 -1.399 0 CA-C-O 122.582 1.182 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.455 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.475 HG23 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.475 ' CE2' HG23 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HG3' HD13 ' A' ' 27' ' ' ILE . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.506 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.478 ' HB2' HG21 ' A' ' 58' ' ' VAL . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.5 ' HA ' HD13 ' A' ' 65' ' ' LEU . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.506 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CE1' HD11 ' B' ' 205' ' ' LEU . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 . . . . . 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 205' ' ' LEU . . . . . 0.403 HD11 ' CE1' ' A' ' 76' ' ' PHE . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.43 -1.47 0 CA-C-O 121.845 0.831 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' B' ' 206' ' ' LEU . 2.0 tm0? . . . . . 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 122.206 1.003 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 65' ' ' LEU 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.0 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t . . . . . 0 N--CA 1.43 -1.442 0 CA-C-O 122.616 1.198 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.487 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.487 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.409 HG23 HD23 ' A' ' 65' ' ' LEU . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HB2' HD21 ' B' ' 206' ' ' LEU . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.429 -1.49 0 CA-C-O 121.152 0.501 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 35' ' ' LEU . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 HG23 ' A' ' 27' ' ' ILE . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 N--CA 1.431 -1.406 0 CA-C-O 120.881 0.372 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 35' ' ' LEU . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 . . . . . 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.43 -1.469 0 CA-C-O 122.703 1.239 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.496 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.684 HD13 HG23 ' B' ' 202' ' ' ILE . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.805 ' HG2' HD12 ' B' ' 206' ' ' LEU 0.319 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m . . . . . 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.444 ' HA ' HD13 ' A' ' 65' ' ' LEU . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 62' ' ' VAL . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 . . . . . 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 202' ' ' ILE . . . . . 0.684 HG23 HD13 ' A' ' 35' ' ' LEU . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 206' ' ' LEU . . . . . 0.805 HD12 ' HG2' ' A' ' 39' ' ' GLN 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 52.3 mp0 . . . . . 0 CA--C 1.49 -1.346 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.265 19.6 m 83.1 123.68 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.293 2.237 . . . . 0.0 114.466 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -84.76 113.53 21.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.313 1.445 . . . . 0.0 111.96 -177.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.0 m -142.42 26.11 1.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 122.75 1.262 . . . . 0.0 111.666 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.86 -47.41 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 176.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.422 HG12 ' H ' ' A' ' 27' ' ' ILE . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -19.08 65.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -43.74 -40.45 4.3 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 129.507 3.123 . . . . 0.0 116.817 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -40.01 -50.15 2.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.832 2.853 . . . . 0.0 117.393 177.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -58.38 -32.14 68.3 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.999 1.72 . . . . 0.0 115.524 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.5 mt -103.34 -9.38 19.52 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.594 -1.317 . . . . 0.0 112.14 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -80.84 -39.93 25.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.96 1.304 . . . . 0.0 111.666 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.3 p -81.74 166.54 19.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.251 1.02 . . . . 0.0 111.828 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -110.7 56.21 0.64 Allowed 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.211 -1.556 . . . . 0.0 107.201 165.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 169.47 -99.6 0.15 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.774 -1.204 . . . . 0.0 113.315 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -86.99 153.66 54.68 Favored Pre-proline 0 N--CA 1.43 -1.434 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -165.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.0 167.72 26.43 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 122.904 2.403 . . . . 0.0 113.651 168.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.39 -161.36 1.16 Allowed 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.835 -1.166 . . . . 0.0 109.944 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -102.92 -12.68 17.33 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 120.138 -1.601 . . . . 0.0 113.185 177.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.3 -89.63 1.63 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.981 -1.074 . . . . 0.0 110.475 -173.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.3 -147.65 0.22 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.31 1.444 . . . . 0.0 108.412 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p -91.25 131.25 36.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.454 -1.404 . . . . 0.0 110.419 167.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -71.85 -35.29 69.8 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -88.82 -2.94 58.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.643 1.577 . . . . 0.0 110.159 -174.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 74.3 mt -99.56 106.88 42.52 Favored Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.578 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -77.36 92.11 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.978 0 C-N-CA 122.273 1.982 . . . . 0.0 112.506 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -100.9 -87.28 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.513 -0.742 . . . . 0.0 112.655 174.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.53 -39.22 3.03 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.282 -0.886 . . . . 0.0 109.617 -165.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.7 tttp 72.27 65.81 0.13 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.824 2.45 . . . . 0.0 112.139 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--O 1.26 1.626 0 C-N-CA 124.632 1.173 . . . . 0.0 110.254 178.504 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.489 -1.375 0 CA-C-O 122.03 0.919 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.0 mtm180 -117.5 43.16 2.42 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.023 -1.673 . . . . 0.0 111.516 -173.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 43.1 mtp -84.76 84.39 7.7 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.94 -1.725 . . . . 0.0 111.669 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -122.96 173.32 7.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 172.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -60.72 -39.75 89.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -62.71 -40.0 95.79 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.524 -1.36 . . . . 0.0 112.585 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.92 -28.48 62.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.254 1.422 . . . . 0.0 113.881 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -65.08 -42.2 94.34 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 126.425 1.89 . . . . 0.0 111.769 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.08 -25.12 65.18 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.77 -46.22 63.33 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.884 -1.135 . . . . 0.0 114.052 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 125.853 1.661 . . . . 0.0 115.03 -179.683 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 . . . . . 0 CA--C 1.489 -1.378 0 CA-C-O 121.195 0.521 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -147.24 125.34 12.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.525 -1.359 . . . . 0.0 109.198 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -125.71 -42.82 1.9 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 123.776 0.831 . . . . 0.0 112.27 -173.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.4 m -76.63 33.2 0.13 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t -49.09 -53.48 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 129.338 3.055 . . . . 0.0 113.847 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.462 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.462 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 72' ' ' LEU . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.473 ' HG3' HD13 ' A' ' 27' ' ' ILE . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.567 HD13 ' HB3' ' A' ' 61' ' ' GLU . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -17.19 64.09 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -46.59 -29.91 2.04 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 117.321 2.341 . . . . 0.0 117.321 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -45.55 -47.31 14.39 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 127.829 2.452 . . . . 0.0 115.035 167.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.65 18.54 10.75 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.605 1.962 . . . . 0.0 115.524 165.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.8 mt 70.67 35.67 1.79 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.618 2.367 . . . . 0.0 113.078 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -68.53 -33.44 74.11 Favored 'General case' 0 CA--C 1.49 -1.365 0 C-N-CA 125.755 1.622 . . . . 0.0 112.381 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.31 169.29 18.05 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 121.497 -0.752 . . . . 0.0 109.55 164.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -116.2 129.53 56.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.624 1.569 . . . . 0.0 107.601 177.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 147.42 -81.05 0.21 Allowed Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.727 -1.233 . . . . 0.0 113.925 173.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -116.24 157.12 46.13 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 125.105 1.362 . . . . 0.0 111.804 -171.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.37 116.31 4.3 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 C-N-CA 123.106 2.537 . . . . 0.0 112.442 168.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -99.95 -77.25 0.53 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.883 1.273 . . . . 0.0 108.038 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.02 -29.4 49.45 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 121.169 -0.957 . . . . 0.0 110.529 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.05 3.48 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 125.696 1.617 . . . . 0.0 114.251 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.329 0.0 OUTLIER 20.66 -132.02 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.468 1 C-N-CA 132.516 4.326 . . . . 0.0 118.781 165.763 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p -97.6 137.06 37.1 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 163.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.422 ' HB2' HD22 ' A' ' 80' ' ' LEU . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 62' ' ' VAL 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.567 ' HB3' HD13 ' A' ' 34' ' ' ILE . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.65 ' HA ' HD23 ' A' ' 65' ' ' LEU . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 62' ' ' VAL . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.413 HD13 HG12 ' A' ' 17' ' ' ILE . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -42.24 -45.12 4.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -97.1 -52.19 3.94 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.0 0.92 . . . . 0.0 109.819 168.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.386 18.0 mt -42.35 -82.14 0.01 OUTLIER Pre-proline 0 N--CA 1.429 -1.477 0 N-CA-C 120.283 3.438 . . . . 0.0 120.283 -149.678 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -73.23 101.61 1.37 Allowed 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 126.992 3.533 . . . . 0.0 113.675 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.72 -57.03 6.23 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.836 1.655 . . . . 0.0 112.532 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -165.09 91.5 0.54 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -100.71 -58.58 1.87 Allowed 'General case' 0 N--CA 1.428 -1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 112.592 -163.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.0 mtm105 . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.577 1.151 . . . . 0.0 111.572 177.785 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.8 m . . . . . 0 CA--C 1.489 -1.369 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 52.0 mtm-85 72.42 156.49 0.17 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.707 1.603 . . . . 0.0 112.955 -170.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.0 mtt -77.04 166.13 23.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.17 -1.582 . . . . 0.0 112.854 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -173.71 -178.71 1.65 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.704 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 -57.13 -25.6 59.12 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -64.36 -36.15 83.21 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.56 1.144 . . . . 0.0 113.617 171.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -73.26 -50.52 21.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.072 -1.642 . . . . 0.0 110.273 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.86 -20.12 65.57 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 127.584 2.354 . . . . 0.0 115.99 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.07 -19.51 5.0 Favored 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 127.818 2.447 . . . . 0.0 115.894 170.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -59.86 -35.09 74.06 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 172.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.2 p80 . . . . . 0 C--O 1.26 1.625 0 C-N-CA 124.153 0.981 . . . . 0.0 111.99 -178.855 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 120.568 0.223 . . . . 0.0 111.516 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.0 p -140.63 144.18 35.61 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.429 -1.419 . . . . 0.0 108.797 160.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -120.04 -69.09 0.86 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.451 1.1 . . . . 0.0 108.088 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.1 m 68.01 35.57 3.67 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 166.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.4 -44.41 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.347 1.859 . . . . 0.0 111.463 175.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.474 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.474 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.35 -19.64 49.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -59.04 -36.42 74.97 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 128.698 2.799 . . . . 0.0 115.998 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.61 -32.77 41.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.125 0.964 . . . . 0.0 111.879 176.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -86.54 -51.82 5.94 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.886 1.274 . . . . 0.0 113.724 -168.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.26 74.2 mt 53.23 -139.69 1.0 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.28 2.232 . . . . 0.0 116.222 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -135.63 52.83 1.99 Allowed 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.124 -1.61 . . . . 0.0 110.246 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.4 t -92.5 158.41 16.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.538 -1.351 . . . . 0.0 110.847 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 120.51 42.66 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.7 -1.25 . . . . 0.0 111.108 -172.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.21 -107.57 0.33 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.079 -1.013 . . . . 0.0 113.427 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.9 ptm85 -72.02 159.3 85.83 Favored Pre-proline 0 N--CA 1.429 -1.497 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -168.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 109.12 2.81 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.502 2.135 . . . . 0.0 112.396 167.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -107.01 154.47 21.07 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.3 ptt-85 -154.12 109.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.799 1.285 . . . . 0.0 108.148 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.24 117.28 8.31 Favored Glycine 0 N--CA 1.432 -1.615 0 O-C-N 120.746 -1.221 . . . . 0.0 113.35 172.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.288 24.6 ptt? 44.73 -134.51 0.68 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.862 2.465 . . . . 0.0 117.354 162.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t -116.06 135.96 53.46 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 158.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -66.86 -19.68 65.78 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -95.48 -46.02 6.85 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.036 -1.04 . . . . 0.0 110.739 162.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.472 HD21 HD12 ' B' ' 202' ' ' ILE . 93.4 mt -82.86 162.34 55.42 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -158.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -74.99 136.4 20.37 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 122.617 1.97 . . . . 0.0 113.407 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -125.51 83.51 2.17 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.13 1.443 . . . . 0.0 109.532 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.39 46.11 1.72 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.42 1.488 . . . . 0.0 107.14 -173.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -90.13 -45.36 9.18 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.091 -161.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--O 1.26 1.622 0 C-N-CA 124.242 1.017 . . . . 0.0 111.859 177.298 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 25.2 m . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -161.64 -177.4 5.88 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.283 -0.885 . . . . 0.0 110.676 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.1 ptp -77.22 66.46 3.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.27 -1.519 . . . . 0.0 114.75 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.04 145.4 55.96 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.644 -1.91 . . . . 0.0 111.007 173.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 80' ' ' LEU 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 215' ' ' ARG . . . . . 0.442 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER -64.45 -25.23 67.92 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.23 -40.07 64.98 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.352 -1.467 . . . . 0.0 111.812 171.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -63.71 -47.46 81.04 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.695 1.198 . . . . 0.0 113.514 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -53.92 -42.77 69.14 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 127.311 2.245 . . . . 0.0 116.484 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.58 -19.67 58.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.29 -17.62 56.36 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 20.7 m170 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -178.115 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 mp0 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m 75.74 177.36 0.2 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.133 1.773 . . . . 0.0 112.955 174.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -117.53 129.67 55.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.075 -1.016 . . . . 0.0 111.974 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.3 m 68.04 37.56 2.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 152.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -50.41 -60.57 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 127.869 2.468 . . . . 0.0 115.99 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.433 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -69.66 -16.02 63.28 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -40.38 -33.11 0.23 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 129.495 3.118 . . . . 0.0 118.712 174.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -58.82 -19.46 41.59 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 171.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -118.34 -55.67 2.21 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.74 1.616 . . . . 0.0 112.652 176.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.2 mt 63.68 -75.42 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 127.097 2.159 . . . . 0.0 116.154 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -146.52 12.65 1.18 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.72 1.208 . . . . 0.0 109.24 175.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -130.58 -168.35 1.97 Allowed 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.853 -1.779 . . . . 0.0 109.711 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -76.62 163.68 26.63 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.126 1.371 . . . . 0.0 112.171 -175.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -80.16 101.99 2.01 Favored Glycine 0 N--CA 1.43 -1.753 0 O-C-N 120.427 -1.421 . . . . 0.0 113.479 -171.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -75.02 155.46 86.48 Favored Pre-proline 0 N--CA 1.429 -1.488 0 C-N-CA 124.228 1.011 . . . . 0.0 110.979 175.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -70.44 79.67 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.977 0 C-N-CA 122.167 1.911 . . . . 0.0 113.417 160.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -93.05 -132.31 0.14 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.566 1.946 . . . . 0.0 109.421 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.04 -109.7 0.31 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.157 -1.589 . . . . 0.0 108.6 166.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.63 124.91 2.36 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.197 -1.564 . . . . 0.0 109.619 -168.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.44 ' HG3' ' H ' ' A' ' 53' ' ' MET . 0.0 OUTLIER -73.36 -156.15 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 126.911 2.084 . . . . 0.0 113.435 -178.035 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.422 ' H ' ' HB2' ' A' ' 53' ' ' MET . 61.9 m -106.23 148.76 27.55 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.906 -1.121 . . . . 0.0 109.84 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 65' ' ' LEU 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -55.08 -45.88 75.43 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -85.84 -50.91 6.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.654 1.182 . . . . 0.0 111.153 167.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.0 mt -76.28 158.99 81.04 Favored Pre-proline 0 N--CA 1.429 -1.502 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -158.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -69.01 152.78 73.16 Favored 'Trans proline' 0 C--N 1.3 -2.026 0 C-N-CA 122.44 2.093 . . . . 0.0 112.919 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -78.5 -52.85 7.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.965 0.888 . . . . 0.0 109.67 165.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.1 -78.82 0.11 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -150.14 63.33 0.97 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.487 1.613 . . . . 0.0 109.667 167.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.155 1.782 . . . . 0.0 111.097 167.788 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 CA--C 1.491 -1.321 0 CA-C-O 123.581 1.657 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -114.27 62.8 0.66 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.152 -2.218 . . . . 0.0 109.395 -178.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.96 65.7 6.2 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.661 1.584 . . . . 0.0 109.944 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -72.29 162.45 29.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 -172.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.414 HG23 HD13 ' A' ' 35' ' ' LEU 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -65.64 -39.47 91.45 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -60.02 -52.08 66.9 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.469 -1.394 . . . . 0.0 112.558 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -60.6 -38.17 83.82 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -69.01 -49.12 60.57 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.589 1.555 . . . . 0.0 113.597 175.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.02 -30.21 69.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.969 1.308 . . . . 0.0 113.661 -177.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -57.39 -52.33 65.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 121.149 -0.969 . . . . 0.0 113.388 171.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 C--O 1.26 1.607 0 C-N-CA 126.471 1.908 . . . . 0.0 115.504 169.791 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 120.97 0.414 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.271 1.0 OUTLIER 77.49 -173.25 0.08 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.212 2.205 . . . . 0.0 111.302 177.743 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.33 -82.98 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.262 -1.524 . . . . 0.0 113.821 -177.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.26 4.1 m 75.11 88.22 0.09 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.421 2.288 . . . . 0.0 109.686 -165.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t -73.33 -49.14 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 126.441 1.896 . . . . 0.0 108.04 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE2' HD11 ' A' ' 17' ' ' ILE . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 14' ' ' VAL . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.426 HD11 ' CE2' ' A' ' 13' ' ' TYR . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 61' ' ' GLU . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.667 HD13 HG23 ' B' ' 202' ' ' ILE . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.83 -17.21 62.9 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -51.77 -35.68 44.66 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 126.833 2.053 . . . . 0.0 115.451 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -62.54 -41.02 98.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.429 -1.419 . . . . 0.0 114.177 177.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 57.25 34.27 24.53 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.083 2.153 . . . . 0.0 115.496 164.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.8 mt 66.02 13.96 9.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.246 2.618 . . . . 0.0 115.565 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -91.28 61.68 4.52 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.02 -1.675 . . . . 0.0 111.383 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.8 m -80.4 96.71 6.79 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.703 -1.248 . . . . 0.0 112.692 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -95.0 -44.84 7.51 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.025 1.33 . . . . 0.0 110.944 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -133.43 -115.56 1.62 Allowed Glycine 0 N--CA 1.43 -1.718 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -100.27 161.0 25.54 Favored Pre-proline 0 N--CA 1.429 -1.513 0 O-C-N 121.696 -0.885 . . . . 0.0 111.17 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -72.66 157.64 51.94 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.251 1.967 . . . . 0.0 113.88 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -122.84 -86.03 0.65 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.92 1.288 . . . . 0.0 109.107 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.33 -55.88 3.93 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.712 -1.243 . . . . 0.0 110.992 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.47 107.57 2.19 Favored Glycine 0 N--CA 1.429 -1.768 0 CA-C-O 121.93 0.739 . . . . 0.0 114.325 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -92.28 -123.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.487 2.315 . . . . 0.0 114.011 -172.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -110.1 158.61 18.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.841 1.656 . . . . 0.0 110.383 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.435 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 34' ' ' ILE . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HA ' HD13 ' A' ' 65' ' ' LEU . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -53.24 -46.68 69.27 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.75 -26.26 14.1 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.128 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.333 18.1 mt -64.77 -82.64 0.03 OUTLIER Pre-proline 0 N--CA 1.43 -1.471 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 -169.197 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.28 163.8 36.94 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 CA-C-N 127.405 3.68 . . . . 0.0 112.393 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -99.44 0.07 Allowed 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.525 1.13 . . . . 0.0 113.717 -165.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -111.66 -35.66 5.7 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.218 -1.551 . . . . 0.0 108.207 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 16.5 mtmt 63.1 61.41 1.1 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.897 2.479 . . . . 0.0 111.607 -172.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.317 2.5 mpt_? . . . . . 0 C--O 1.26 1.652 0 C-N-CA 128.889 2.876 . . . . 0.0 112.412 -165.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 CA--C 1.491 -1.309 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 2.5 ttt85 67.34 137.82 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 0.0 114.654 -175.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 28.1 ptm -71.99 52.57 0.24 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 119.757 3.243 . . . . 0.0 119.757 -166.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -104.08 -156.15 0.56 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.568 -1.957 . . . . 0.0 112.816 177.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.667 HG23 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -53.96 -43.23 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -57.94 -37.11 73.51 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.272 1.429 . . . . 0.0 114.725 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 13.1 mmp_? -70.67 -39.13 73.73 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.219 -0.926 . . . . 0.0 112.838 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -73.27 -44.75 58.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.453 1.501 . . . . 0.0 113.325 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.21 -18.8 39.95 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.689 2.396 . . . . 0.0 115.637 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -58.48 -41.88 86.26 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 170.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 21.9 p80 . . . . . 0 C--O 1.261 1.679 0 C-N-CA 123.654 0.782 . . . . 0.0 112.276 -169.829 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.327 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 p -64.83 154.86 35.87 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -166.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -89.68 -63.0 1.35 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.774 1.23 . . . . 0.0 109.054 -176.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 m 77.59 29.02 0.55 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.215 1.806 . . . . 0.0 115.593 163.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 5' ' ' VAL . 22.0 t -51.49 -54.27 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 C-N-CA 127.54 2.336 . . . . 0.0 113.514 176.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.415 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.507 HD13 HG23 ' B' ' 202' ' ' ILE . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.547 ' HG2' HD23 ' B' ' 206' ' ' LEU 0.332 0.0 OUTLIER -80.0 -18.14 51.04 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -72.16 -56.58 5.32 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.203 -1.56 . . . . 0.0 112.444 173.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -46.8 -42.79 17.66 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.326 1.851 . . . . 0.0 114.601 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -54.56 -23.48 16.93 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.693 1.997 . . . . 0.0 116.092 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.79 -27.73 69.09 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 118.944 -2.348 . . . . 0.0 113.725 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -116.02 26.12 10.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.903 -1.123 . . . . 0.0 113.242 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.7 p -95.43 164.5 12.79 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.18 -1.575 . . . . 0.0 112.824 175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -104.97 150.75 24.65 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.008 2.123 . . . . 0.0 107.747 169.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.46 -56.78 5.07 Favored Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.26 -1.525 . . . . 0.0 115.226 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 23.7 76.08 0.25 Allowed Pre-proline 0 N--CA 1.431 -1.406 0 C-N-CA 131.067 3.747 . . . . 0.0 119.029 -176.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -80.19 14.05 2.04 Favored 'Trans proline' 0 N--CA 1.434 -2.012 0 C-N-CA 123.186 2.591 . . . . 0.0 116.796 -172.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 63.18 120.13 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 128.564 2.746 . . . . 0.0 114.645 -169.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 ptt85 -159.69 -77.21 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.967 0.907 . . . . 0.0 110.005 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.81 58.81 1.09 Allowed Glycine 0 N--CA 1.43 -1.763 0 C-N-CA 124.59 1.091 . . . . 0.0 110.567 -171.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.367 0.0 OUTLIER 46.28 -133.14 1.02 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.219 2.208 . . . . 0.0 114.625 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p -91.64 127.4 37.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 158.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.55 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -66.44 -23.8 66.35 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -87.85 -20.37 26.13 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.48 1.512 . . . . 0.0 112.023 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.7 mt -108.77 104.25 54.05 Favored Pre-proline 0 N--CA 1.43 -1.455 0 O-C-N 120.963 -1.086 . . . . 0.0 112.932 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -76.21 117.83 4.76 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 123.311 2.674 . . . . 0.0 113.716 -174.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.77 -54.57 3.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.631 1.205 . . . . 0.0 111.815 177.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.0 -51.29 0.14 Allowed 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.319 47.8 mtpt 78.45 23.22 0.68 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.052 2.541 . . . . 0.0 114.345 176.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.297 27.8 mmt180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 128.136 2.574 . . . . 0.0 115.888 173.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 198' ' ' VAL . . . . . 0.511 ' N ' HE22 ' B' ' 203' ' ' GLN . 73.9 t . . . . . 0 CA--C 1.489 -1.367 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -69.19 98.34 1.01 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -168.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.301 51.3 mtp 58.43 80.57 0.18 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.828 2.851 . . . . 0.0 116.328 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -139.96 166.47 24.55 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.291 1.437 . . . . 0.0 107.602 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.507 HG23 HD13 ' A' ' 35' ' ' LEU . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 203' ' ' GLN . . . . . 0.511 HE22 ' N ' ' B' ' 198' ' ' VAL . 0.7 OUTLIER -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 39' ' ' GLN . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 -56.75 -30.87 64.01 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -76.03 -35.69 59.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.456 -1.403 . . . . 0.0 112.883 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -65.1 -26.28 68.14 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.294 -1.504 . . . . 0.0 113.943 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -80.27 -19.62 46.34 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -78.81 -18.49 54.0 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.797 -1.189 . . . . 0.0 112.572 175.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.61 -55.42 35.12 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.91 1.684 . . . . 0.0 115.54 -174.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 C--O 1.261 1.676 0 C-N-CA 125.677 1.591 . . . . 0.0 114.519 176.65 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 . . . . . 0 CA--C 1.49 -1.346 0 CA-C-O 121.514 0.673 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.2 p -143.57 173.87 11.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.065 0.946 . . . . 0.0 109.376 172.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -120.7 130.0 53.89 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 167.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 m -117.47 34.74 4.99 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 120.065 -1.647 . . . . 0.0 112.23 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.5 -54.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 126.342 1.857 . . . . 0.0 112.848 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.445 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.534 HD13 HG23 ' B' ' 202' ' ' ILE . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -21.94 64.5 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -42.45 -40.61 2.63 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 129.784 3.234 . . . . 0.0 118.206 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -79.82 -18.69 50.27 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -79.42 -70.87 0.48 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.051 -1.03 . . . . 0.0 112.394 -176.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.4 mt 52.12 -122.23 1.97 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.119 2.168 . . . . 0.0 114.521 -171.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -100.51 85.49 2.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.335 -1.478 . . . . 0.0 109.527 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 t -74.06 137.32 43.27 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.575 1.178 . . . . 0.0 114.053 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -83.75 -59.86 2.3 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.05 1.74 . . . . 0.0 111.67 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -111.79 -58.86 0.45 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.37 -0.831 . . . . 0.0 112.703 -173.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -88.42 129.74 48.23 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -164.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -77.78 151.1 27.87 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 C-N-CA 122.549 2.166 . . . . 0.0 111.818 165.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -118.77 163.22 17.19 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.231 1.412 . . . . 0.0 111.502 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -108.43 -55.41 2.39 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.863 1.265 . . . . 0.0 111.223 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 140.73 -154.11 24.09 Favored Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.445 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -88.02 -138.6 0.11 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 163.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -74.45 121.85 22.1 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.907 -1.746 . . . . 0.0 110.583 167.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.498 ' HA ' HD13 ' A' ' 65' ' ' LEU . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.52 -45.41 72.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -98.22 -18.92 18.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.2 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.327 1.0 OUTLIER -37.01 -71.55 0.11 Allowed Pre-proline 0 N--CA 1.43 -1.439 1 N-CA-C 121.999 4.074 . . . . 0.0 121.999 -170.798 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -80.69 176.18 9.32 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.839 3.026 . . . . 0.0 114.455 -169.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.01 -33.92 67.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.18 -108.04 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 176.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -143.57 -55.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 110.388 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.285 59.2 mtt180 . . . . . 0 C--O 1.26 1.617 0 N-CA-C 115.95 1.833 . . . . 0.0 115.95 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -90.13 139.94 30.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.441 -1.412 . . . . 0.0 111.372 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.8 ttp -100.5 -69.29 0.78 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.093 -1.004 . . . . 0.0 110.237 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 50.12 -141.05 0.74 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.936 2.494 . . . . 0.0 112.856 -174.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.534 HG23 HD13 ' A' ' 35' ' ' LEU . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -56.88 -34.56 67.98 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -64.63 -35.57 81.45 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 125.233 1.413 . . . . 0.0 113.958 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 59.3 mmt-85 -66.29 -41.4 89.84 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.433 1.493 . . . . 0.0 112.132 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.21 -30.61 67.74 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.681 -1.262 . . . . 0.0 113.572 177.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -72.31 -25.4 61.55 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.019 0.928 . . . . 0.0 113.369 171.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -42.11 75.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.16 1.384 . . . . 0.0 113.552 -173.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 C--O 1.26 1.614 0 C-N-CA 124.32 1.048 . . . . 0.0 111.621 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 . . . . . 0 CA--C 1.49 -1.331 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m 72.76 174.18 0.29 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.852 2.461 . . . . 0.0 113.837 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.19 -98.83 0.24 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.203 -1.561 . . . . 0.0 109.044 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -105.15 88.08 2.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.276 1.988 . . . . 0.0 112.575 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.61 -52.56 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.736 2.015 . . . . 0.0 109.121 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.679 HG22 HG23 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.407 ' CE1' HD12 ' B' ' 206' ' ' LEU . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.71 -20.86 61.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -47.53 -47.06 28.15 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.668 1.987 . . . . 0.0 114.84 172.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -81.85 -57.52 3.39 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.094 0.958 . . . . 0.0 111.57 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 64.94 -44.33 0.33 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 129.24 3.016 . . . . 0.0 116.872 -175.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.6 mt -84.36 145.91 27.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.605 -1.309 . . . . 0.0 113.36 -164.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.6 m80 -94.71 80.9 3.79 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.332 -1.48 . . . . 0.0 109.631 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.2 p -117.13 153.47 32.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-O 122.865 1.317 . . . . 0.0 113.216 -171.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -87.96 118.28 27.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.057 1.343 . . . . 0.0 108.876 167.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 142.84 -55.5 0.58 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -76.11 155.11 84.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 120.787 -1.419 . . . . 0.0 114.026 -173.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -81.09 -168.57 0.64 Allowed 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 122.647 2.232 . . . . 0.0 111.63 162.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.45 -138.74 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.458 1 C-N-CA 132.177 4.191 . . . . 0.0 120.139 172.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 74.75 -68.65 0.21 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.255 2.622 . . . . 0.0 112.169 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.92 122.32 5.71 Favored Glycine 0 N--CA 1.43 -1.749 0 N-CA-C 108.843 -1.703 . . . . 0.0 108.843 176.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -139.98 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -149.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m -113.4 145.92 40.35 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.078 1.351 . . . . 0.0 110.674 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.679 HG23 HG22 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.542 ' O ' HD12 ' A' ' 65' ' ' LEU 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.451 HG21 HD21 ' A' ' 35' ' ' LEU . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.542 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.53 -22.53 58.98 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.73 -5.04 49.33 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.189 1.396 . . . . 0.0 110.108 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.1 mt -108.74 170.77 5.1 Favored Pre-proline 0 N--CA 1.43 -1.448 0 O-C-N 120.917 -1.115 . . . . 0.0 111.935 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -64.39 146.32 89.53 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 C-N-CA 122.348 2.032 . . . . 0.0 114.805 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -60.19 -46.94 87.99 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -162.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.08 -40.87 0.06 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.152 -1.592 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.268 41.6 mtpt 75.18 45.01 0.15 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 129.163 2.985 . . . . 0.0 111.825 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.797 1.239 . . . . 0.0 112.153 -177.368 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.49 -1.339 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 62.2 -147.21 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.622 1.169 . . . . 0.0 113.905 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 16.9 ttt -36.35 103.79 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.332 2.653 . . . . 0.0 117.512 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -158.06 -177.86 6.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 108.69 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.621 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -55.12 -43.46 74.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.5 -30.68 66.24 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.406 1.483 . . . . 0.0 113.949 176.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -64.85 -41.67 95.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.384 -1.448 . . . . 0.0 113.847 170.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -73.71 -21.03 60.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.462 -2.023 . . . . 0.0 114.499 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.75 -17.35 62.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 167.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -58.5 -18.0 25.67 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.26 1.645 0 N-CA-C 117.326 2.343 . . . . 0.0 117.326 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 CA--C 1.49 -1.359 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.7 p -108.71 103.94 13.13 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.916 -1.115 . . . . 0.0 111.736 -170.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -85.85 -84.03 0.17 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.855 -1.153 . . . . 0.0 111.153 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -138.1 29.42 2.51 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.487 1.137 . . . . 0.0 111.441 -164.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.38 -49.42 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.702 2.001 . . . . 0.0 110.417 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.495 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' HD13 ' A' ' 27' ' ' ILE . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -19.19 60.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.8 mmmt -64.5 -45.48 87.09 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.744 -1.848 . . . . 0.0 112.343 170.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -63.03 -40.93 99.2 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -74.43 -25.96 59.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mt -6.7 76.88 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 131.034 3.734 . . . . 0.0 120.188 -176.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 81.5 t60 39.05 54.78 2.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.768 2.827 . . . . 0.0 115.064 -177.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 t -73.68 139.12 45.17 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.964 -1.085 . . . . 0.0 113.732 -168.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -95.18 142.91 27.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.847 -1.158 . . . . 0.0 110.507 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.11 -103.44 1.31 Allowed Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -93.8 166.67 15.32 Favored Pre-proline 0 N--CA 1.429 -1.482 0 C-N-CA 124.351 1.061 . . . . 0.0 111.716 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.11 160.82 39.36 Favored 'Trans proline' 0 C--N 1.3 -2.019 0 C-N-CA 122.045 1.83 . . . . 0.0 111.668 160.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -127.65 158.36 37.77 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.062 0.945 . . . . 0.0 108.476 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -99.5 -78.44 0.5 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 160.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.28 -133.29 4.17 Favored Glycine 0 N--CA 1.429 -1.777 0 N-CA-C 106.091 -2.804 . . . . 0.0 106.091 -176.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.35 -157.96 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.068 2.147 . . . . 0.0 114.328 165.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m -85.33 128.53 34.73 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.173 -2.205 . . . . 0.0 108.909 172.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.49 ' HA ' HD13 ' A' ' 65' ' ' LEU . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.415 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -64.67 -25.66 68.05 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -97.64 -57.3 2.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.512 0.725 . . . . 0.0 110.527 160.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.333 16.7 mt -41.11 -65.13 0.5 Allowed Pre-proline 0 N--CA 1.43 -1.436 1 N-CA-C 122.365 4.209 . . . . 0.0 122.365 -148.937 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -69.94 126.64 13.42 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 124.642 2.694 . . . . 0.0 112.448 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -71.19 -53.63 13.77 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -165.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -130.78 -41.43 1.17 Allowed 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.902 -1.124 . . . . 0.0 109.878 -175.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.5 tttp 69.77 36.45 2.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.134 1.774 . . . . 0.0 114.404 170.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 . . . . . 0 C--O 1.26 1.633 0 O-C-N 120.145 -1.597 . . . . 0.0 112.634 178.843 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.489 -1.378 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -146.48 162.17 38.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.394 -1.441 . . . . 0.0 108.015 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.3 40.0 mmm 70.26 0.51 3.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -73.75 174.33 8.57 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.247 -1.533 . . . . 0.0 113.323 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.456 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.521 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -54.02 -37.99 64.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -75.5 -32.24 60.47 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.215 2.206 . . . . 0.0 115.042 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -34.95 67.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.446 -1.409 . . . . 0.0 111.588 171.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -65.17 -36.22 83.54 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.116 1.766 . . . . 0.0 114.565 173.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.88 -16.87 46.58 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 128.411 2.684 . . . . 0.0 116.316 173.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -56.6 -28.36 60.19 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.245 1.818 . . . . 0.0 114.933 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 C--O 1.26 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 108.912 163.667 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 CA--C 1.49 -1.332 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 m 78.05 137.65 0.06 Allowed 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 128.233 2.613 . . . . 0.0 115.72 171.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -70.43 -57.78 4.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.015 -1.678 . . . . 0.0 113.167 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -103.78 82.14 1.97 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.273 1.987 . . . . 0.0 110.656 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.26 -46.91 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 130.974 3.709 . . . . 0.0 110.022 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.413 ' CE1' HD11 ' A' ' 11' ' ' ILE . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 7' ' ' PHE . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.533 HG23 HD23 ' A' ' 65' ' ' LEU . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.734 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.8 -23.25 65.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -41.88 -49.3 4.51 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.679 2.392 . . . . 0.0 116.619 172.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -66.44 -19.29 65.76 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.268 1.427 . . . . 0.0 114.667 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.2 -10.68 46.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.805 -1.184 . . . . 0.0 113.038 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.7 mt -86.58 -147.89 0.13 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.807 1.243 . . . . 0.0 111.233 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -113.63 56.68 0.69 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.314 -2.116 . . . . 0.0 110.501 -173.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.5 t -97.23 -38.91 9.51 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.952 -1.092 . . . . 0.0 111.284 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -127.18 -66.43 0.89 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 121.121 -0.987 . . . . 0.0 109.753 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 50.51 0.62 Allowed Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 125.339 1.447 . . . . 0.0 113.723 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -111.88 149.58 41.04 Favored Pre-proline 0 N--CA 1.429 -1.485 0 CA-C-O 117.633 -1.175 . . . . 0.0 109.982 167.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.22 118.06 5.36 Favored 'Trans proline' 0 N--CA 1.433 -2.044 0 C-N-CA 123.181 2.587 . . . . 0.0 111.283 174.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.7 167.86 29.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -161.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -104.66 -62.58 1.31 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.289 1.036 . . . . 0.0 108.947 170.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.67 -74.87 0.11 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.585 -1.322 . . . . 0.0 111.795 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -165.82 -136.15 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 127.387 2.275 . . . . 0.0 108.153 -164.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m -91.56 117.88 30.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.101 -0.999 . . . . 0.0 111.146 163.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 65' ' ' LEU . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.533 HD23 HG23 ' A' ' 27' ' ' ILE . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -75.6 -28.24 58.81 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -84.36 -12.96 53.58 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 125.733 1.613 . . . . 0.0 109.782 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.4 102.9 53.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 C-N-CA 124.515 1.126 . . . . 0.0 112.155 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -68.97 105.76 1.41 Allowed 'Trans proline' 0 N--CA 1.433 -2.038 0 C-N-CA 123.065 2.51 . . . . 0.0 114.132 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.32 -42.08 31.79 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.079 -1.638 . . . . 0.0 113.807 177.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -132.81 -35.9 1.07 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.886 -1.134 . . . . 0.0 111.07 -173.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.308 47.3 mttm 100.18 9.33 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.471 1 C-N-CA 131.778 4.031 . . . . 0.0 112.039 -175.499 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.286 38.3 mtm180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 129.653 3.181 . . . . 0.0 113.998 178.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 120.543 0.211 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -144.24 153.04 41.64 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.888 -1.132 . . . . 0.0 112.032 -171.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 32.4 tpp -91.13 137.45 32.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.685 1.594 . . . . 0.0 111.664 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -160.63 179.32 8.66 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 166.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.579 HG23 HD13 ' A' ' 35' ' ' LEU . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.734 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -68.35 -31.88 71.58 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.19 -30.02 57.87 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.212 -1.555 . . . . 0.0 112.273 172.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -68.27 -28.95 67.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.595 -1.315 . . . . 0.0 114.086 170.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -60.26 -24.63 65.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.291 2.236 . . . . 0.0 115.885 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.39 -21.53 66.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.421 1.488 . . . . 0.0 115.015 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -69.76 -22.1 63.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.26 1.619 0 O-C-N 120.698 -1.251 . . . . 0.0 111.034 -179.085 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 . . . . . 0 CA--C 1.491 -1.311 0 CA-C-O 122.525 1.155 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 m -68.95 143.98 54.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.653 -1.904 . . . . 0.0 114.08 -173.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -91.89 -59.16 2.18 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 122.452 1.12 . . . . 0.0 109.675 -177.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -92.27 88.14 6.34 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.35 2.024 . . . . 0.0 114.434 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t -76.64 -45.4 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 127.471 2.308 . . . . 0.0 109.301 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.419 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -44.44 22.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -75.4 -57.85 3.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.311 1.444 . . . . 0.0 113.154 -172.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -50.1 -45.27 52.62 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.232 1.813 . . . . 0.0 114.707 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -76.8 -4.88 45.84 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.432 1.493 . . . . 0.0 114.96 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 mt -82.17 27.75 0.47 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.255 -2.153 . . . . 0.0 115.221 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -95.59 41.33 1.1 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.66 -1.9 . . . . 0.0 110.473 170.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.9 t -139.43 132.2 29.09 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 173.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -8.82 -87.75 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 130.082 3.353 . . . . 0.0 119.643 -161.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.98 46.27 0.89 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.067 -1.646 . . . . 0.0 111.243 175.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -125.52 123.95 25.0 Favored Pre-proline 0 N--CA 1.429 -1.507 0 O-C-N 121.577 -0.955 . . . . 0.0 113.093 -174.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.97 115.24 3.98 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 122.525 2.15 . . . . 0.0 111.225 165.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -158.17 166.7 31.77 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.698 -0.626 . . . . 0.0 109.728 -173.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 85.81 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.866 2.866 . . . . 0.0 112.451 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.36 -168.9 41.34 Favored Glycine 0 N--CA 1.43 -1.722 0 C-N-CA 124.982 1.277 . . . . 0.0 111.995 -155.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.36 -132.53 0.3 Allowed 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.548 -1.56 . . . . 0.0 108.32 158.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -71.58 112.74 7.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.611 1.165 . . . . 0.0 111.227 172.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -73.19 -35.97 66.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.37 -14.07 47.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.376 1.87 . . . . 0.0 109.863 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.5 mt -91.87 170.2 9.81 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 124.595 1.158 . . . . 0.0 111.26 171.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -68.17 153.13 75.4 Favored 'Trans proline' 0 N--CA 1.433 -2.03 0 C-N-CA 122.062 1.841 . . . . 0.0 112.868 166.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -69.84 -40.95 75.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -174.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.73 -96.73 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt -152.66 74.59 1.07 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 169.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 125.995 1.718 . . . . 0.0 112.385 -175.427 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 116.69 2.107 . . . . 0.0 116.69 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.271 42.3 mtp85 76.66 168.59 0.25 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.343 1.857 . . . . 0.0 114.028 173.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.7 ptm -116.51 109.19 16.94 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.976 1.37 . . . . 0.0 112.341 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.962 1.705 . . . . 0.0 107.019 170.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -64.09 -38.32 90.65 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -64.57 -26.48 68.43 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.611 -1.306 . . . . 0.0 114.127 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -70.1 -47.19 62.87 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.436 -1.415 . . . . 0.0 112.484 166.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -54.78 -37.53 66.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.715 1.606 . . . . 0.0 115.077 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -45.59 -19.07 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 129.711 3.205 . . . . 0.0 118.978 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -18.54 64.86 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.537 -1.977 . . . . 0.0 115.127 170.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.26 1.605 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 2' ' ' SER 0.284 0.6 OUTLIER . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 119.444 -0.312 . . . . 0.0 110.694 . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.543 ' H ' ' HG2' ' A' ' 1' ' ' GLU . 10.2 m -166.78 143.83 4.8 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.285 -1.509 . . . . 0.0 107.017 166.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 p30 -104.84 -82.36 0.52 Allowed 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 124.216 1.006 . . . . 0.0 110.905 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.3 m -138.11 36.35 2.33 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.473 1.909 . . . . 0.0 108.593 -173.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 5' ' ' VAL . 28.1 t -48.66 -53.67 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 128.126 2.57 . . . . 0.0 114.224 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 37.0 m80 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -18.92 60.94 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -59.39 -42.11 90.95 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.168 -1.582 . . . . 0.0 113.532 172.092 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.94 -19.1 64.17 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 -170.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.98 -30.54 71.54 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.941 2.496 . . . . 0.0 114.136 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.0 mt -89.57 170.33 10.58 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.271 1.028 . . . . 0.0 111.366 -173.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -82.01 73.81 9.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.618 -1.926 . . . . 0.0 110.335 169.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -81.96 -68.87 0.66 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.815 1.646 . . . . 0.0 111.347 -173.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -101.79 -56.3 2.31 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.356 -1.465 . . . . 0.0 111.138 -174.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.91 -66.93 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.764 0 O-C-N 121.495 -0.753 . . . . 0.0 112.278 -175.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -109.95 158.79 34.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 121.775 -0.838 . . . . 0.0 112.039 -172.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.97 123.61 8.03 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.172 1.915 . . . . 0.0 113.85 173.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -100.2 161.43 13.61 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 158.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.1 mtp-105 -76.64 -48.94 17.47 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.526 -1.984 . . . . 0.0 115.703 -166.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 118.77 70.5 0.35 Allowed Glycine 0 N--CA 1.43 -1.723 0 N-CA-C 108.169 -1.972 . . . . 0.0 108.169 -167.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.421 0.0 OUTLIER 17.21 -146.59 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.404 1 C-N-CA 132.807 4.443 . . . . 0.0 120.68 -173.819 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p -95.16 132.09 40.48 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.617 -1.302 . . . . 0.0 109.02 167.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 65' ' ' LEU . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 202' ' ' ILE . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -67.8 -37.9 82.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -72.2 -60.65 2.13 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 123.607 0.763 . . . . 0.0 111.208 157.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 mt -74.26 116.5 53.33 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -159.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.04 96.63 1.09 Allowed 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.707 2.271 . . . . 0.0 112.401 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -85.27 -43.6 13.61 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.61 -15.07 0.38 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.848 -1.158 . . . . 0.0 112.777 -170.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 61.07 31.98 19.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.283 2.633 . . . . 0.0 112.811 -167.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 91.7 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 126.944 2.098 . . . . 0.0 109.006 -171.042 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -115.61 -173.66 2.38 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.852 -1.155 . . . . 0.0 110.589 177.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.1 tpt -55.06 75.79 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.347 3.459 . . . . 0.0 115.265 167.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -127.08 -178.29 4.37 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.454 -1.404 . . . . 0.0 111.071 170.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.463 HD11 ' CZ ' ' A' ' 76' ' ' PHE 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -58.77 -40.74 84.81 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -68.17 -26.49 65.78 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.854 -1.154 . . . . 0.0 113.719 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -69.62 -26.71 64.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.407 -1.433 . . . . 0.0 114.043 177.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -73.87 -30.05 62.43 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.025 -1.672 . . . . 0.0 113.551 172.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -69.48 -15.8 63.34 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.668 1.587 . . . . 0.0 113.876 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.04 -18.31 63.29 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.854 -1.779 . . . . 0.0 114.746 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 C--O 1.261 1.678 0 O-C-N 120.927 -1.108 . . . . 0.0 113.892 -175.674 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -152.42 110.13 3.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.943 -1.098 . . . . 0.0 108.636 168.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -101.85 107.65 18.89 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.378 -0.826 . . . . 0.0 111.765 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.0 m -144.57 85.38 1.77 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.192 0.997 . . . . 0.0 111.172 -175.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.87 -45.34 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 127.926 2.49 . . . . 0.0 111.549 177.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HG3' HD13 ' A' ' 27' ' ' ILE . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.588 HD12 HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 23.7 m80 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.26 -15.52 58.69 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -40.62 -39.16 1.0 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.788 2.835 . . . . 0.0 117.744 178.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -58.5 -27.81 64.81 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.204 2.202 . . . . 0.0 115.703 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 69.49 8.71 6.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.776 2.83 . . . . 0.0 115.379 175.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.251 92.9 mt 73.45 109.75 0.07 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 129.502 3.121 . . . . 0.0 113.338 -173.417 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -127.33 76.16 1.64 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 124.703 1.201 . . . . 0.0 107.832 169.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.356 12.2 t 47.2 -143.54 0.36 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 128.361 2.664 . . . . 0.0 115.082 176.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -128.58 134.78 48.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.677 -1.889 . . . . 0.0 106.229 160.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.28 -86.44 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.084 -1.01 . . . . 0.0 111.584 -177.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -106.54 162.5 19.5 Favored Pre-proline 0 N--CA 1.43 -1.456 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.209 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -65.19 138.69 57.28 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 CA-C-N 123.151 2.161 . . . . 0.0 115.068 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -115.98 -164.48 0.96 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.241 1.417 . . . . 0.0 108.328 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -73.24 -22.95 60.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.69 -1.881 . . . . 0.0 115.208 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.89 157.72 53.16 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-O 123.299 1.499 . . . . 0.0 112.227 175.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.423 ' HB2' ' H ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -120.67 -141.29 0.34 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.517 1.527 . . . . 0.0 110.22 -170.302 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 53' ' ' MET . 21.9 p -109.96 146.0 35.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.452 1.501 . . . . 0.0 110.983 -178.644 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' HD13 ' A' ' 65' ' ' LEU . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 62' ' ' VAL . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -55.11 -40.08 70.06 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -93.29 -38.16 11.66 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 123.844 0.858 . . . . 0.0 110.531 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.72 146.29 31.47 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -160.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.94 150.6 61.28 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.818 2.345 . . . . 0.0 114.315 -170.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -76.18 -74.55 0.22 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -153.67 -54.18 0.11 Allowed 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.674 -1.266 . . . . 0.0 107.942 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 68.69 28.24 5.69 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.748 2.019 . . . . 0.0 113.481 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 C--O 1.26 1.621 0 C-N-CA 126.626 1.97 . . . . 0.0 114.008 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 CA--C 1.49 -1.347 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -149.98 78.53 1.35 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.286 1.035 . . . . 0.0 109.484 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.0 mmt 64.22 23.37 13.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.995 2.118 . . . . 0.0 115.83 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -54.56 140.88 33.41 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.915 1.686 . . . . 0.0 112.982 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.494 HG23 HD13 ' A' ' 35' ' ' LEU 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.588 HD21 HD12 ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -58.25 -28.2 64.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.82 -26.56 64.26 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.056 2.143 . . . . 0.0 114.535 175.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -38.48 77.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.594 -1.316 . . . . 0.0 113.222 173.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -81.08 -20.46 41.47 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.29 -1.506 . . . . 0.0 112.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.25 -17.89 22.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.467 1.907 . . . . 0.0 115.417 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -62.07 -18.64 61.33 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.427 2.01 . . . . 0.0 116.427 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 221' ' ' HIS . . . . . 0.436 ' OXT' ' CD2' ' B' ' 221' ' ' HIS . 11.2 p-80 . . . . . 0 C--O 1.26 1.627 0 C-N-CA 127.536 2.334 . . . . 0.0 116.704 -171.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 CA--C 1.49 -1.362 0 CA-C-O 119.86 -0.115 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m -147.32 167.16 25.01 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 161.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -99.4 -90.06 0.31 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.389 -0.82 . . . . 0.0 110.437 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.6 m -79.28 89.71 4.94 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.933 1.349 . . . . 0.0 112.242 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t -80.49 -48.22 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 127.252 2.221 . . . . 0.0 109.578 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.491 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 14' ' ' VAL . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.414 ' HG2' HD23 ' B' ' 206' ' ' LEU . 0.0 OUTLIER -76.13 -19.14 58.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.8 tttm -52.68 -40.04 62.5 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.296 2.238 . . . . 0.0 114.423 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -72.17 -20.54 61.57 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.846 -1.159 . . . . 0.0 113.847 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -74.29 -19.87 60.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.996 -1.065 . . . . 0.0 112.616 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.79 -65.4 1.01 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.803 1.241 . . . . 0.0 113.225 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -144.74 65.21 1.28 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.318 -1.489 . . . . 0.0 112.636 -174.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.7 t -83.31 127.6 33.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.485 0.66 . . . . 0.0 111.507 167.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -122.52 74.59 1.19 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.071 -1.643 . . . . 0.0 109.131 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.67 -76.12 0.11 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.64 -1.288 . . . . 0.0 110.809 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -93.04 117.18 67.43 Favored Pre-proline 0 N--CA 1.43 -1.452 0 O-C-N 121.722 -0.869 . . . . 0.0 110.644 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.75 98.11 1.12 Allowed 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.804 2.336 . . . . 0.0 111.274 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.61 173.79 6.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.955 1.359 . . . . 0.0 112.086 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -138.14 -115.38 0.16 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 168.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.9 162.27 42.68 Favored Glycine 0 N--CA 1.43 -1.763 0 O-C-N 120.415 -1.428 . . . . 0.0 113.273 169.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.73 -116.91 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.133 1.773 . . . . 0.0 108.707 169.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -86.32 117.88 25.41 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.342 -1.474 . . . . 0.0 110.015 149.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' HD12 ' A' ' 65' ' ' LEU . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.409 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -46.61 -40.08 12.32 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -92.04 -53.26 4.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.337 1.055 . . . . 0.0 110.587 172.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.313 79.7 mt -65.4 -79.55 0.05 OUTLIER Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -149.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.82 143.37 33.25 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 CA-C-N 126.345 3.302 . . . . 0.0 113.053 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.3 -72.85 0.26 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.773 1.229 . . . . 0.0 113.613 -176.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.35 -54.11 0.22 Allowed 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.882 -1.137 . . . . 0.0 108.358 174.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 18.5 mmtp 80.46 -19.7 0.42 Allowed 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 129.001 2.92 . . . . 0.0 114.462 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.9 mmm-85 . . . . . 0 C--O 1.26 1.635 0 C-N-CA 128.676 2.791 . . . . 0.0 113.864 -175.955 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 CA--C 1.491 -1.327 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -74.6 171.31 14.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.493 -2.004 . . . . 0.0 112.781 172.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 11.4 ptm -76.21 74.44 3.03 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 123.544 1.64 . . . . 0.0 110.434 167.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -90.26 -177.96 5.26 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.088 1.755 . . . . 0.0 112.391 -167.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.17 -36.6 73.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.89 -44.58 84.86 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.67 1.588 . . . . 0.0 112.216 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -72.39 -37.7 68.65 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -69.27 -30.1 68.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.175 1.39 . . . . 0.0 114.737 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -51.94 -37.44 52.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 -176.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.27 -49.72 10.4 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 C--O 1.26 1.657 0 C-N-CA 128.472 2.709 . . . . 0.0 116.563 -173.852 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.5 p -156.14 111.3 2.92 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 121.852 2.115 . . . . 0.0 115.78 165.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -79.68 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.181 1.393 . . . . 0.0 111.643 171.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -93.49 23.58 4.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.999 -1.688 . . . . 0.0 114.033 -168.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t -63.11 -48.68 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.676 1.99 . . . . 0.0 112.038 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.517 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HG3' HD13 ' A' ' 27' ' ' ILE . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.512 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 61' ' ' GLU . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB2' HD11 ' B' ' 206' ' ' LEU . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 27.9 m170 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? -61.99 -25.53 67.69 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -48.31 -32.49 7.46 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.159 2.584 . . . . 0.0 116.325 174.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -25.87 5.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.172 2.189 . . . . 0.0 116.526 171.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -73.04 -19.03 61.26 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.593 1.557 . . . . 0.0 113.836 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.26 161.39 29.96 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.989 -1.694 . . . . 0.0 113.465 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -84.91 69.75 10.81 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.24 1.416 . . . . 0.0 111.121 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.5 m -78.58 150.27 32.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.243 1.817 . . . . 0.0 109.801 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -85.18 135.35 33.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.033 -1.667 . . . . 0.0 110.964 -176.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.71 -70.49 3.17 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.087 -1.633 . . . . 0.0 114.607 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.298 0.0 OUTLIER 18.24 80.23 0.12 Allowed Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 121.468 3.877 . . . . 0.0 121.468 -176.364 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -80.21 0.36 10.07 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 C-N-CA 122.275 1.983 . . . . 0.0 114.245 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -172.6 160.05 4.56 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.688 2.795 . . . . 0.0 107.729 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.293 10.6 ptp180 -176.48 -42.94 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.028 1.331 . . . . 0.0 113.994 150.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.7 49.11 4.18 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.219 -1.551 . . . . 0.0 115.765 -172.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.8 ptt? 37.22 -138.8 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 118.933 2.938 . . . . 0.0 118.933 156.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m -116.22 144.16 44.56 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.136 1.374 . . . . 0.0 109.164 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HB3' HD13 ' A' ' 34' ' ' ILE . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 65' ' ' LEU . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -42.87 -43.63 4.15 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -108.61 -43.74 4.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.938 1.295 . . . . 0.0 111.577 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.4 mt -75.66 161.54 75.81 Favored Pre-proline 0 N--CA 1.43 -1.446 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -163.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -62.53 130.02 28.54 Favored 'Trans proline' 0 N--CA 1.433 -2.031 0 C-N-CA 122.629 2.219 . . . . 0.0 113.312 171.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -70.05 -69.01 0.38 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -166.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -117.7 -65.36 1.19 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.9 ttmt -161.56 -69.67 0.06 Allowed 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.825 162.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.638 0 C-N-CA 125.243 1.417 . . . . 0.0 112.047 -175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 CA--C 1.491 -1.314 0 CA-C-O 120.86 0.362 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -94.73 160.12 14.76 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 124.091 0.957 . . . . 0.0 110.872 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.9 ptm -70.29 63.0 0.24 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -90.85 -176.8 4.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.487 -2.008 . . . . 0.0 112.675 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -60.87 -24.25 65.8 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.69 -44.68 77.59 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.692 1.597 . . . . 0.0 113.961 169.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -67.88 -20.34 65.11 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.245 -1.534 . . . . 0.0 114.216 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -77.34 -24.78 50.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.61 -1.306 . . . . 0.0 112.771 175.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -77.81 -30.31 51.13 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.941 -1.099 . . . . 0.0 111.614 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -71.6 -50.04 34.65 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.64 -1.287 . . . . 0.0 112.357 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.254 68.1 m80 . . . . . 0 C--O 1.259 1.579 0 C-N-CA 127.072 2.149 . . . . 0.0 112.705 -175.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.491 -1.292 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.25 70.0 m 75.27 168.7 0.28 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.166 2.186 . . . . 0.0 112.685 179.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -149.61 -91.87 0.07 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.555 -1.341 . . . . 0.0 109.491 177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 m -112.67 26.55 10.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.162 -1.586 . . . . 0.0 112.931 -175.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.78 -56.54 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 127.072 2.149 . . . . 0.0 110.831 -176.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.439 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.681 HD13 HG23 ' B' ' 202' ' ' ILE . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.421 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -19.29 64.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -40.45 -45.26 2.18 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 129.492 3.117 . . . . 0.0 117.235 175.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.9 -31.35 71.64 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -81.31 -8.33 59.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.988 1.315 . . . . 0.0 112.697 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.7 mt -77.16 -55.28 5.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.667 -1.271 . . . . 0.0 109.914 166.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.73 -47.18 55.55 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -176.061 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.348 29.2 p 67.37 -137.63 0.12 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.536 1.934 . . . . 0.0 114.922 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt 42.45 50.66 4.76 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 129.392 3.077 . . . . 0.0 117.272 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.14 50.34 0.83 Allowed Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.898 1.237 . . . . 0.0 112.679 177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.4 ptt85 -72.33 114.5 30.18 Favored Pre-proline 0 N--CA 1.43 -1.43 0 O-C-N 121.858 -0.789 . . . . 0.0 111.877 174.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -90.45 -2.66 5.21 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 122.761 2.022 . . . . 0.0 114.097 -159.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -151.06 -161.15 1.28 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.547 1.539 . . . . 0.0 107.367 -177.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 32.0 ptt85 -129.07 72.74 1.48 Allowed 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.25 1.5 . . . . 0.0 110.487 170.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.4 -96.39 0.28 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.98 1.752 . . . . 0.0 112.341 -172.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.421 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -153.59 -153.61 0.48 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.103 1.361 . . . . 0.0 109.621 -171.976 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m -78.42 131.74 37.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 119.77 -1.831 . . . . 0.0 112.644 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 65' ' ' LEU . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.55 -21.98 38.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -72.76 -30.81 64.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.086 1.354 . . . . 0.0 110.327 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.15 162.52 40.24 Favored Pre-proline 0 N--CA 1.43 -1.433 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -172.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 125.63 9.24 Favored 'Trans proline' 0 C--N 1.299 -2.033 0 C-N-CA 122.399 2.066 . . . . 0.0 113.84 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -108.69 -42.28 4.56 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 123.361 0.664 . . . . 0.0 110.957 162.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.87 -106.92 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm -131.29 36.63 3.79 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.248 -0.908 . . . . 0.0 110.112 157.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 C--O 1.261 1.673 0 O-C-N 120.301 -1.499 . . . . 0.0 109.833 173.806 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 CA--C 1.491 -1.317 0 CA-C-O 119.112 -0.471 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -107.77 -153.94 0.51 Allowed 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 120.464 1.484 . . . . 0.0 108.352 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 45.1 mtp -84.7 -110.07 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.797 -1.19 . . . . 0.0 110.351 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 75.63 162.7 0.25 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.084 1.754 . . . . 0.0 112.473 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 35' ' ' LEU . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 35' ' ' LEU . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.96 -25.15 61.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.3 -27.56 53.02 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.206 1.002 . . . . 0.0 112.465 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -28.88 69.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.967 1.307 . . . . 0.0 113.357 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.48 -27.37 66.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.966 2.106 . . . . 0.0 115.651 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.79 -27.18 55.15 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.088 -1.632 . . . . 0.0 112.774 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -70.19 -56.21 7.4 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.371 1.068 . . . . 0.0 113.099 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.297 74.5 m80 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 127.4 2.28 . . . . 0.0 113.146 -176.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.33 49.0 m 85.37 117.73 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.36 3.064 . . . . 0.0 114.052 -176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.67 -74.05 0.28 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.997 1.719 . . . . 0.0 111.735 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.6 p -151.15 92.16 1.77 Allowed 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.152 1.381 . . . . 0.0 109.567 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t -75.72 -43.31 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.557 1.943 . . . . 0.0 108.125 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.434 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.651 HD13 HG23 ' B' ' 202' ' ' ILE . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -21.89 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -44.61 -47.39 10.4 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 129.396 3.078 . . . . 0.0 116.648 166.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.34 -26.2 68.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.63 1.572 . . . . 0.0 114.47 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -77.33 -32.71 55.39 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.101 -1.625 . . . . 0.0 112.607 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.55 -50.05 8.05 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.021 -1.05 . . . . 0.0 112.088 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -114.2 73.66 0.83 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.829 1.652 . . . . 0.0 108.353 -177.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -77.03 122.49 25.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.694 1.198 . . . . 0.0 114.014 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -91.36 69.66 5.98 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.219 1.485 . . . . 0.0 113.376 -167.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.67 -66.21 3.88 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.111 -1.618 . . . . 0.0 114.41 177.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -80.39 141.64 53.35 Favored Pre-proline 0 N--CA 1.43 -1.427 0 O-C-N 120.986 -1.302 . . . . 0.0 111.452 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -75.88 100.96 1.43 Allowed 'Trans proline' 0 C--N 1.3 -2.019 0 CA-C-N 123.108 2.146 . . . . 0.0 111.996 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -125.21 154.68 41.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.317 1.447 . . . . 0.0 108.782 -172.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -113.29 -79.38 0.58 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.157 0.983 . . . . 0.0 110.23 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.29 169.71 25.73 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-O 123.675 1.708 . . . . 0.0 112.934 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -143.48 0.11 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.822 2.449 . . . . 0.0 111.19 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m -72.3 123.73 23.61 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.959 -1.713 . . . . 0.0 110.826 167.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' HD23 ' A' ' 65' ' ' LEU . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 62' ' ' VAL . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.54 -20.8 65.46 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -90.92 -13.34 33.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 123.989 0.916 . . . . 0.0 110.131 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.95 93.93 48.89 Favored Pre-proline 0 N--CA 1.431 -1.388 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -63.36 108.01 0.77 Allowed 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 123.977 3.118 . . . . 0.0 112.658 168.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.41 -56.54 6.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 -169.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 84' ' ' LYS . . . -161.31 -19.56 0.05 OUTLIER 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -172.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 83' ' ' ALA 0.259 74.6 tttt 77.45 66.74 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 128.307 2.643 . . . . 0.0 111.974 -169.78 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 . . . . . 0 C--O 1.261 1.662 0 C-N-CA 126.526 1.931 . . . . 0.0 109.619 175.757 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 121.061 0.457 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -127.08 131.53 50.86 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.779 -1.201 . . . . 0.0 109.375 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 29.5 mtp -75.52 93.46 3.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.221 -0.924 . . . . 0.0 111.208 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -131.2 173.06 11.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 171.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.651 HG23 HD13 ' A' ' 35' ' ' LEU . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.438 HD21 HD12 ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -64.42 -47.41 79.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -67.2 -38.83 85.98 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.384 1.073 . . . . 0.0 112.634 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -72.49 -23.53 61.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -74.05 -45.0 52.27 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 120.182 -1.574 . . . . 0.0 112.662 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.83 -29.38 54.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.722 2.009 . . . . 0.0 115.574 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -53.97 -43.7 70.13 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.611 2.364 . . . . 0.0 114.472 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 128.087 2.555 . . . . 0.0 115.898 -173.842 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.005 0.431 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.285 72.4 m 78.52 118.46 0.06 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.878 2.471 . . . . 0.0 115.208 170.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -87.43 -17.1 33.0 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.655 1.582 . . . . 0.0 111.179 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.0 m -76.7 82.03 3.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.247 2.219 . . . . 0.0 114.278 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t -81.34 -59.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.041 2.136 . . . . 0.0 110.384 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.456 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.496 HG21 ' HB2' ' A' ' 61' ' ' GLU . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD11 HD22 ' B' ' 205' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -44.4 28.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -60.54 -36.55 78.71 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 127.535 2.334 . . . . 0.0 115.095 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -71.0 -19.65 62.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.434 1.494 . . . . 0.0 114.895 174.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -94.05 -74.61 0.53 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.392 1.077 . . . . 0.0 110.807 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.3 mt -121.0 132.21 54.77 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.91 1.284 . . . . 0.0 109.076 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . 0.266 10.2 p-80 -153.01 -73.79 0.13 Allowed 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.474 -1.391 . . . . 0.0 111.3 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 t -120.83 -56.15 1.96 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.079 0.952 . . . . 0.0 110.805 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -136.3 163.84 29.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.404 1.482 . . . . 0.0 107.71 -172.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.93 83.54 0.6 Allowed Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 125.025 1.298 . . . . 0.0 114.193 175.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -66.19 175.3 1.32 Allowed Pre-proline 0 N--CA 1.429 -1.485 0 C-N-CA 127.474 2.31 . . . . 0.0 113.159 163.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.44 123.37 11.97 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 122.547 2.165 . . . . 0.0 111.837 164.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.46 135.57 42.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.983 1.313 . . . . 0.0 110.855 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 53.2 mmm-85 -130.81 -114.63 0.24 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.21 119.26 0.22 Allowed Glycine 0 N--CA 1.431 -1.69 0 CA-C-O 123.19 1.439 . . . . 0.0 112.531 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -152.6 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.22 1.485 . . . . 0.0 113.207 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m -94.44 140.89 29.23 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.324 1.45 . . . . 0.0 111.338 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HB2' HG21 ' A' ' 34' ' ' ILE . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -49.32 -32.19 10.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -109.23 -39.71 5.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.609 1.164 . . . . 0.0 111.071 166.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 39.1 mt -83.79 131.75 50.93 Favored Pre-proline 0 N--CA 1.43 -1.426 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -164.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -67.53 118.17 5.39 Favored 'Trans proline' 0 C--N 1.299 -2.049 0 CA-C-N 123.451 2.268 . . . . 0.0 114.622 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -75.63 -71.85 0.35 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.868 1.267 . . . . 0.0 111.703 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -134.73 -32.98 0.97 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.849 1.26 . . . . 0.0 109.905 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.266 9.3 ttpt 78.06 78.51 0.07 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.809 2.444 . . . . 0.0 111.525 175.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 . . . . . 0 C--O 1.26 1.624 0 C-N-CA 127.24 2.216 . . . . 0.0 111.129 -173.679 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 121.533 0.683 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.6 mtp180 -124.56 -177.18 3.73 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.3 mmm -83.4 -135.72 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.408 -1.433 . . . . 0.0 110.682 168.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 79.36 165.67 0.19 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.422 2.289 . . . . 0.0 110.945 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 35' ' ' LEU 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.447 HD22 HD11 ' A' ' 35' ' ' LEU . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.36 -28.58 68.3 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.87 -39.85 90.76 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.897 1.679 . . . . 0.0 113.332 170.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -77.23 -41.79 39.85 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.889 1.276 . . . . 0.0 110.992 -178.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.0 -30.63 70.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 126.408 1.883 . . . . 0.0 115.194 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -43.85 -31.53 0.87 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 129.326 3.051 . . . . 0.0 118.018 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.91 -31.89 65.36 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 . . . . . 0 C--O 1.26 1.634 0 C-N-CA 125.912 1.685 . . . . 0.0 114.159 -179.908 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 . . . . . 0 CA--C 1.49 -1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -159.58 129.51 5.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.832 -1.167 . . . . 0.0 110.631 170.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -128.76 104.51 7.67 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.146 -0.972 . . . . 0.0 110.484 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 m 50.55 91.4 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.03 -52.59 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.132 1.773 . . . . 0.0 109.832 -176.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.454 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.621 HD13 HG23 ' B' ' 202' ' ' ILE . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -67.25 -19.59 65.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -39.26 -39.84 0.68 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 129.51 3.124 . . . . 0.0 117.413 178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -49.57 -35.79 21.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.275 2.63 . . . . 0.0 115.895 169.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 73.93 -1.18 3.14 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 127.269 2.227 . . . . 0.0 116.026 169.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.51 48.86 17.89 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.958 2.103 . . . . 0.0 114.002 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -104.62 -50.43 3.3 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.865 1.266 . . . . 0.0 110.594 -172.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -92.81 170.34 9.77 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.121 -0.987 . . . . 0.0 110.024 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -129.23 134.11 47.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.042 1.337 . . . . 0.0 108.19 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.84 -90.7 0.08 OUTLIER Glycine 0 N--CA 1.43 -1.751 0 O-C-N 120.361 -1.462 . . . . 0.0 113.278 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -113.74 155.77 44.61 Favored Pre-proline 0 N--CA 1.43 -1.442 0 O-C-N 121.587 -0.949 . . . . 0.0 111.667 -172.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -71.5 114.89 4.08 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 123.451 2.768 . . . . 0.0 112.001 164.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.83 148.14 25.94 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.272 45.5 mtp180 71.75 -45.48 0.62 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.057 2.543 . . . . 0.0 116.978 169.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.82 20.83 26.2 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 125.397 1.475 . . . . 0.0 114.026 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 49.61 -142.71 0.58 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.113 2.634 . . . . 0.0 118.113 149.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p -107.16 142.69 36.46 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 166.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 65' ' ' LEU . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -43.57 -42.99 5.36 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -106.48 -45.77 4.18 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.871 1.268 . . . . 0.0 110.964 175.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.4 mt -75.59 158.45 83.14 Favored Pre-proline 0 N--CA 1.43 -1.464 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -161.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.73 106.66 1.88 Allowed 'Trans proline' 0 C--N 1.3 -2.011 0 C-N-CA 122.563 2.175 . . . . 0.0 112.426 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -55.85 23.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.863 2.065 . . . . 0.0 113.491 -175.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.12 -73.39 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 103.778 -2.675 . . . . 0.0 103.778 168.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -165.51 20.33 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? . . . . . 0 C--O 1.259 1.599 0 O-C-N 120.383 -1.448 . . . . 0.0 111.137 170.984 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -105.98 -162.08 0.84 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.414 -1.429 . . . . 0.0 110.329 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.4 mtt -101.75 151.15 22.39 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.806 -1.184 . . . . 0.0 112.772 -177.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -154.42 -178.2 6.99 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.529 2.732 . . . . 0.0 103.708 166.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.621 HG23 HD13 ' A' ' 35' ' ' LEU . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -58.25 -39.35 78.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -61.06 -45.62 94.0 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.693 1.197 . . . . 0.0 113.898 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -69.52 -37.72 77.27 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.5 1.12 . . . . 0.0 112.345 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.39 -44.93 84.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.4 1.88 . . . . 0.0 112.771 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.3 -30.26 71.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -76.65 -46.59 25.22 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.034 0.934 . . . . 0.0 112.759 173.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.252 10.8 m-70 . . . . . 0 C--O 1.259 1.596 0 C-N-CA 129.068 2.947 . . . . 0.0 112.952 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 119.884 -0.103 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.9 p -148.28 122.91 9.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.77 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -123.97 -60.74 1.42 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.837 -1.164 . . . . 0.0 110.393 169.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.8 m -125.58 35.29 4.75 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 122.982 1.372 . . . . 0.0 112.612 -163.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.59 -49.76 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 126.071 1.749 . . . . 0.0 112.633 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.463 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER -71.92 -17.69 62.07 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -51.27 -29.95 16.29 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 128.157 2.583 . . . . 0.0 115.468 170.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -59.9 -30.73 69.22 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.465 1.506 . . . . 0.0 114.67 169.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -91.23 -72.58 0.57 Allowed 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.713 -1.242 . . . . 0.0 111.743 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.6 mt 45.17 -104.83 0.09 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.662 1.985 . . . . 0.0 115.35 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -93.39 9.92 34.4 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.832 1.653 . . . . 0.0 113.872 -172.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.5 p -112.49 146.56 38.25 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.946 1.831 . . . . 0.0 113.535 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -116.94 166.93 11.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.855 2.062 . . . . 0.0 106.638 165.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.92 -29.75 4.52 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.351 -1.468 . . . . 0.0 115.635 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.94 157.4 30.73 Favored Pre-proline 0 N--CA 1.429 -1.495 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -176.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -61.89 130.13 29.99 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 122.76 2.307 . . . . 0.0 114.846 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -85.84 127.43 34.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.897 0.856 . . . . 0.0 110.307 177.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -131.59 -87.03 0.48 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.026 0.931 . . . . 0.0 108.767 174.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.4 62.75 1.32 Allowed Glycine 0 N--CA 1.43 -1.74 0 O-C-N 121.201 -0.937 . . . . 0.0 113.033 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.293 21.0 ptt? 43.43 -123.35 0.79 Allowed 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 165.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m -108.15 122.85 47.75 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 148.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -59.1 -46.79 87.4 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.76 -50.13 22.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.099 1.36 . . . . 0.0 111.136 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.9 152.83 69.42 Favored Pre-proline 0 N--CA 1.431 -1.41 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -161.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.91 106.45 2.14 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 C-N-CA 122.51 2.14 . . . . 0.0 113.33 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -79.62 -70.69 0.49 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -154.41 -84.89 0.06 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -169.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -158.63 74.29 0.67 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.852 0.861 . . . . 0.0 109.409 161.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER . . . . . 0 C--O 1.259 1.601 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 167.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 CA--C 1.489 -1.372 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -122.3 143.05 49.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.587 -1.321 . . . . 0.0 108.324 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.1 ptp -80.14 72.4 6.94 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.49 -1.381 . . . . 0.0 113.246 166.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -69.31 147.67 50.82 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 119.242 -2.161 . . . . 0.0 108.656 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.609 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -73.22 -29.05 62.53 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -76.14 -38.19 57.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.08 -1.012 . . . . 0.0 112.926 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.58 -37.61 84.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.095 -1.003 . . . . 0.0 113.004 175.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.9 -47.92 70.28 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.685 1.994 . . . . 0.0 112.063 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.89 -42.79 99.9 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.031 1.332 . . . . 0.0 114.442 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -75.95 -29.23 58.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -176.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.258 3.8 p80 . . . . . 0 C--O 1.26 1.652 0 C-N-CA 127.083 2.153 . . . . 0.0 115.405 -177.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.354 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 p -143.77 151.61 40.2 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.628 . . . . 0.0 114.97 170.722 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -121.04 -59.75 1.7 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.577 1.951 . . . . 0.0 109.585 -173.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.8 m -90.24 76.1 6.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.513 -1.367 . . . . 0.0 111.919 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.54 -52.5 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 C-N-CA 126.528 1.931 . . . . 0.0 109.94 -172.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 27' ' ' ILE . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.645 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -18.37 60.65 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -52.51 -32.22 39.22 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.087 2.155 . . . . 0.0 114.172 172.657 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -64.87 -21.95 66.9 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.082 1.353 . . . . 0.0 114.548 178.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -80.78 -20.76 41.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.414 1.486 . . . . 0.0 112.812 177.023 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.0 mt -92.12 11.27 26.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.901 -1.749 . . . . 0.0 113.444 -173.039 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -89.57 -64.41 1.14 Allowed 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.951 -1.093 . . . . 0.0 113.049 -170.235 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -158.47 159.14 35.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.19 -0.944 . . . . 0.0 111.018 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -114.32 108.61 17.14 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.693 -1.254 . . . . 0.0 111.793 -167.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.87 -37.19 0.82 Allowed Glycine 0 N--CA 1.43 -1.743 0 O-C-N 121.179 -0.95 . . . . 0.0 113.984 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -103.25 163.49 17.37 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.92 177.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -62.2 136.0 57.73 Favored 'Trans proline' 0 C--N 1.3 -1.997 0 C-N-CA 122.498 2.132 . . . . 0.0 114.554 176.153 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -65.79 -45.37 82.68 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -174.609 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 66.39 94.27 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.801 2.04 . . . . 0.0 113.543 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.54 68.4 0.4 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.308 5.8 ptt? 43.19 -140.38 0.18 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.398 2.279 . . . . 0.0 115.93 170.917 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p -102.78 139.66 38.07 Favored 'General case' 0 N--CA 1.432 -1.373 0 O-C-N 120.673 -1.267 . . . . 0.0 110.064 163.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 61' ' ' GLU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -49.27 -36.26 20.11 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -97.21 -49.05 5.11 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.21 -0.931 . . . . 0.0 109.51 168.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 mt -77.97 130.23 73.45 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -153.873 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -71.65 116.23 4.62 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.905 2.403 . . . . 0.0 115.033 171.039 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -74.25 -60.82 2.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 118.794 0.724 . . . . 0.0 111.937 170.863 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -125.4 -40.3 2.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.252 1.021 . . . . 0.0 109.986 -170.712 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.0 tptp 70.05 62.01 0.24 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 128.405 2.682 . . . . 0.0 112.875 -178.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 C--O 1.26 1.633 0 C-N-CA 126.317 1.847 . . . . 0.0 110.555 -179.52 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.49 -1.365 0 CA-C-O 120.795 0.331 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -125.12 107.54 10.88 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.05 -1.031 . . . . 0.0 110.216 174.023 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.261 34.1 mtp 71.23 128.64 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 127.554 2.342 . . . . 0.0 113.214 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -164.57 168.01 18.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 -174.125 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -55.4 -34.55 64.48 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -64.34 -33.08 75.01 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.447 -1.408 . . . . 0.0 114.262 174.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -77.18 -50.0 13.93 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.985 -1.072 . . . . 0.0 110.032 175.377 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -47.84 -24.59 1.03 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 129.525 3.13 . . . . 0.0 116.53 -179.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -47.79 -28.59 2.61 Favored 'General case' 0 N--CA 1.428 -1.529 0 C-N-CA 127.337 2.255 . . . . 0.0 116.505 169.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -63.64 -32.34 73.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.304 -1.498 . . . . 0.0 113.858 173.001 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.257 99.8 m-70 . . . . . 0 C--O 1.261 1.673 0 C-N-CA 129.38 3.072 . . . . 0.0 117.197 178.447 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.491 -1.326 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.267 50.1 m 77.86 116.84 0.06 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.263 2.225 . . . . 0.0 113.054 177.251 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -96.56 -36.42 10.76 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.732 1.213 . . . . 0.0 110.751 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 m 64.09 59.86 1.04 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.466 1.906 . . . . 0.0 112.959 -177.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t -66.0 -59.16 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 127.277 2.231 . . . . 0.0 111.76 -167.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.482 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.445 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.563 HD13 HG23 ' B' ' 202' ' ' ILE . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -64.59 -27.21 68.79 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.26 -39.16 72.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.729 2.012 . . . . 0.0 115.304 174.599 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -72.57 -22.96 60.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.029 -1.669 . . . . 0.0 114.706 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -70.06 -10.37 58.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 -168.296 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.2 mt -79.86 -125.03 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.373 -2.08 . . . . 0.0 112.826 174.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -95.16 1.6 54.84 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.451 -2.656 . . . . 0.0 116.364 -174.015 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -63.24 146.34 53.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 121.451 1.932 . . . . 0.0 116.003 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -102.21 -170.07 1.76 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.63 1.972 . . . . 0.0 112.023 -166.536 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 112.04 -89.36 0.53 Allowed Glycine 0 N--CA 1.429 -1.77 0 O-C-N 120.641 -1.287 . . . . 0.0 112.164 174.375 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.4 ptt85 -123.76 169.89 9.55 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 121.166 -1.196 . . . . 0.0 109.379 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.96 172.84 15.56 Favored 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 123.181 2.172 . . . . 0.0 112.644 166.648 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . 0.26 29.5 t80 82.37 128.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.178 2.191 . . . . 0.0 114.899 175.003 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -127.56 -76.03 0.57 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.552 1.541 . . . . 0.0 110.083 -173.07 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.16 106.73 2.2 Favored Glycine 0 N--CA 1.429 -1.786 0 C-N-CA 125.476 1.513 . . . . 0.0 113.579 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -61.74 -143.73 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.327 3.851 . . . . 0.0 114.235 175.208 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m -80.25 124.06 28.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.008 -1.682 . . . . 0.0 110.8 168.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.519 ' HB2' HD22 ' A' ' 80' ' ' LEU . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.412 ' HA ' HD13 ' A' ' 65' ' ' LEU . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -75.55 -21.69 57.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -93.03 -8.87 41.69 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.843 1.257 . . . . 0.0 109.605 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 55' ' ' GLU . 50.7 mt -115.17 80.64 7.35 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.818 -1.176 . . . . 0.0 112.08 177.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.57 170.2 20.83 Favored 'Trans proline' 0 N--CA 1.434 -2.018 0 C-N-CA 123.445 2.764 . . . . 0.0 112.467 -175.928 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -86.19 -74.09 0.43 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.728 -0.607 . . . . 0.0 111.735 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.96 -27.44 0.15 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.11 -0.994 . . . . 0.0 112.045 -179.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt 81.53 40.1 0.05 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.231 2.612 . . . . 0.0 111.618 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 . . . . . 0 C--O 1.259 1.598 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.235 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 121.494 0.664 . . . . 0.0 112.595 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 -140.08 -176.66 4.68 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 105.236 -2.135 . . . . 0.0 105.236 174.531 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.58 79.82 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.548 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -138.0 173.01 12.08 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.186 1.794 . . . . 0.0 107.901 174.085 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.563 HG23 HD13 ' A' ' 35' ' ' LEU . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -64.15 -28.32 69.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -64.58 -26.33 68.36 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.868 -1.77 . . . . 0.0 113.775 177.196 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 14.6 ttp85 -71.36 -20.61 62.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.432 1.641 . . . . 0.0 115.432 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -72.66 -43.84 62.64 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.921 -1.737 . . . . 0.0 110.626 170.357 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.27 -20.1 51.45 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.823 2.049 . . . . 0.0 115.985 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -66.35 -20.84 66.19 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 126.037 1.735 . . . . 0.0 115.479 172.797 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.636 0 O-C-N 120.273 -1.517 . . . . 0.0 114.14 175.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 p -162.08 159.88 26.72 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.1 t70 72.35 -42.99 0.55 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.112 2.165 . . . . 0.0 114.424 -176.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.9 m -83.94 77.67 9.87 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.216 -1.552 . . . . 0.0 113.955 -177.503 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t -72.04 -47.77 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 128.349 2.659 . . . . 0.0 111.623 -179.149 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -16.74 61.66 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -51.68 -35.66 43.49 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 128.398 2.679 . . . . 0.0 115.556 173.448 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -76.15 -22.47 55.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.623 -1.298 . . . . 0.0 113.462 177.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -95.85 -60.71 1.58 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.097 1.359 . . . . 0.0 111.982 -167.077 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt 46.33 -125.93 1.42 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.471 2.308 . . . . 0.0 115.246 -179.036 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -107.66 50.59 0.77 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.132 -1.605 . . . . 0.0 110.274 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.315 50.8 p 55.7 76.31 0.28 Allowed 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.064 2.146 . . . . 0.0 113.876 -175.407 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.1 -37.29 61.56 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.087 -1.008 . . . . 0.0 110.926 -178.2 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -135.63 -57.58 0.06 OUTLIER Glycine 0 N--CA 1.429 -1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 111.669 170.79 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.7 ptt-85 -111.5 146.33 34.43 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 124.91 1.284 . . . . 0.0 111.292 -174.054 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -71.78 145.38 45.87 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.966 2.444 . . . . 0.0 112.983 165.009 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.2 t80 57.85 -138.33 0.88 Allowed 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.77 1.628 . . . . 0.0 114.011 176.279 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.25 23.8 mmm180 68.0 96.83 0.06 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.86 2.464 . . . . 0.0 115.268 178.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.85 82.43 0.34 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.781 -1.824 . . . . 0.0 109.754 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptt? 29.67 -119.17 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 129.23 3.012 . . . . 0.0 116.781 172.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m -105.4 122.33 45.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.997 1.319 . . . . 0.0 108.742 160.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.475 ' HA ' HD13 ' A' ' 65' ' ' LEU . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 62' ' ' VAL . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.2 -37.17 86.18 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -84.13 -45.43 13.0 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.38 -1.45 . . . . 0.0 111.407 165.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.6 mt -77.08 166.74 42.33 Favored Pre-proline 0 N--CA 1.432 -1.362 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 -162.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -67.52 138.6 46.37 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.126 1.884 . . . . 0.0 114.287 172.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.68 -53.41 10.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.459 -0.776 . . . . 0.0 112.211 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.64 -56.37 0.13 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 175.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -164.2 82.78 0.42 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.0 1.381 . . . . 0.0 109.26 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 . . . . . 0 C--O 1.26 1.619 0 C-N-CA 127.198 2.199 . . . . 0.0 115.933 172.111 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 CA--C 1.49 -1.34 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -178.77 5.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.693 -1.88 . . . . 0.0 110.269 172.487 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 70.3 mtp -80.66 -116.08 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.065 -1.022 . . . . 0.0 110.413 174.515 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 78.55 155.86 0.16 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.747 2.019 . . . . 0.0 111.927 179.262 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.65 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -62.79 -26.86 68.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -56.55 -46.76 80.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 171.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -74.36 -35.27 63.54 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 123.76 0.824 . . . . 0.0 112.271 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -70.93 -25.74 62.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.163 -1.586 . . . . 0.0 114.72 176.002 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.97 -24.12 64.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.177 -1.577 . . . . 0.0 113.876 173.487 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -67.24 -51.91 47.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.624 1.17 . . . . 0.0 110.445 174.454 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t60 . . . . . 0 C--O 1.26 1.646 0 C-N-CA 126.082 1.753 . . . . 0.0 115.295 159.419 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 t 84.49 138.4 0.06 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.386 2.275 . . . . 0.0 112.516 168.407 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -93.8 -20.0 20.5 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.369 -0.832 . . . . 0.0 110.812 -178.306 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.5 m -85.66 67.73 10.17 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 124.148 1.928 . . . . 0.0 112.319 178.363 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t -75.16 -49.82 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 128.045 2.538 . . . . 0.0 110.216 -175.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.466 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.457 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.608 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -22.74 57.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -47.28 -26.28 1.19 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 129.124 2.97 . . . . 0.0 116.812 164.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.91 -47.56 67.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.4 2.28 . . . . 0.0 115.898 167.478 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 66.31 4.11 3.06 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 58.8 mt 59.22 89.09 0.06 Allowed 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 129.037 2.935 . . . . 0.0 116.389 175.605 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -88.68 49.81 1.85 Allowed 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.74 -1.85 . . . . 0.0 112.9 -179.265 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.4 t -110.04 -170.54 1.67 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.511 1.524 . . . . 0.0 108.24 174.448 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -74.23 -57.5 3.91 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.881 -1.762 . . . . 0.0 110.726 176.653 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 175.85 32.99 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.709 0 O-C-N 121.473 -0.767 . . . . 0.0 114.707 170.468 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -100.84 163.84 17.28 Favored Pre-proline 0 N--CA 1.43 -1.447 0 CA-C-N 118.558 1.179 . . . . 0.0 110.533 177.866 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -66.65 150.74 83.65 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 CA-C-N 122.315 1.863 . . . . 0.0 113.5 171.114 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.65 -156.52 0.68 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 124.983 1.313 . . . . 0.0 107.878 -175.033 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -94.66 -132.41 0.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 161.868 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.41 71.59 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 105.254 -3.139 . . . . 0.0 105.254 -173.246 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.381 0.0 OUTLIER 47.69 -134.78 1.09 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.075 1.75 . . . . 0.0 113.178 -161.762 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m -79.76 110.19 14.88 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 159.515 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.507 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' A' ' 65' ' ' LEU . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 ' O ' ' A' ' 61' ' ' GLU . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -46.17 -46.47 17.36 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -90.0 -47.51 7.8 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.788 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -80.81 168.92 21.75 Favored Pre-proline 0 N--CA 1.429 -1.487 0 N-CA-C 116.449 2.018 . . . . 0.0 116.449 -161.682 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -63.3 164.42 20.23 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 CA-C-N 123.556 2.306 . . . . 0.0 117.341 -177.341 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 40.39 84.64 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.911 2.884 . . . . 0.0 117.801 -174.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.61 82.19 0.45 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.344 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -70.56 -48.16 56.74 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.261 1.668 0 C-N-CA 124.536 1.135 . . . . 0.0 110.782 171.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 120.848 0.356 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -123.13 59.43 1.08 Allowed 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.646 1.579 . . . . 0.0 107.796 174.564 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.7 mtp 67.08 152.74 0.08 Allowed 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.389 2.676 . . . . 0.0 116.103 -171.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -174.96 -178.21 1.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.431 2.292 . . . . 0.0 104.963 178.445 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.608 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -72.67 -29.0 63.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -61.72 -38.62 88.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.54 1.536 . . . . 0.0 114.302 176.447 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -73.91 -35.41 64.63 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.808 -1.182 . . . . 0.0 113.021 174.78 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.41 -29.2 69.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.179 1.391 . . . . 0.0 114.7 175.292 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -52.13 -21.15 3.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.322 2.649 . . . . 0.0 117.852 -175.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -66.31 -21.58 66.26 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.32 1.448 . . . . 0.0 113.567 175.095 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 120.934 -1.103 . . . . 0.0 108.94 174.682 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 . . . . . 0 CA--C 1.491 -1.32 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m 118.84 167.4 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 131.395 3.878 . . . . 0.0 110.486 173.345 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -82.82 -46.52 12.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.879 -1.138 . . . . 0.0 109.315 164.502 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 p -84.23 74.38 10.32 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.875 1.67 . . . . 0.0 113.451 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t -80.52 -61.72 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.02 1.728 . . . . 0.0 110.733 -176.263 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.513 ' HB2' HG21 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -59.17 -33.08 70.5 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -45.53 -36.0 4.29 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 129.235 3.014 . . . . 0.0 116.985 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -61.83 -31.53 71.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.309 -1.494 . . . . 0.0 115.02 -178.29 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.18 -32.23 55.97 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.794 1.237 . . . . 0.0 112.424 -167.108 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -84.19 84.64 7.54 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.263 1.825 . . . . 0.0 111.695 -172.367 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.6 m170 -85.71 58.53 5.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.437 -2.04 . . . . 0.0 113.925 -167.538 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.5 t -85.41 159.69 19.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.639 -1.288 . . . . 0.0 112.142 179.552 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -88.99 132.25 34.81 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.133 -1.604 . . . . 0.0 110.254 179.947 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 165.19 -67.9 0.2 Allowed Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -173.31 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -131.34 161.23 63.2 Favored Pre-proline 0 N--CA 1.43 -1.467 0 C-N-CA 125.434 1.494 . . . . 0.0 109.457 177.273 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.71 160.05 41.5 Favored 'Trans proline' 0 C--N 1.301 -1.97 0 C-N-CA 122.749 2.299 . . . . 0.0 112.001 168.886 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -115.9 160.84 19.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.609 1.195 . . . . 0.0 112.604 -173.484 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -106.27 -120.09 0.23 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 123.924 0.89 . . . . 0.0 109.792 176.023 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.95 163.85 32.43 Favored Glycine 0 N--CA 1.429 -1.769 0 O-C-N 121.01 -1.056 . . . . 0.0 113.317 -170.457 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.408 ' HE3' ' HB ' ' A' ' 58' ' ' VAL . 7.8 ptt? -156.9 -155.54 0.54 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.865 1.266 . . . . 0.0 111.076 -165.259 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m -110.12 149.65 29.74 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 121.303 -0.873 . . . . 0.0 110.248 174.269 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 65' ' ' LEU 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CE1' HD11 ' B' ' 202' ' ' ILE . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -75.61 -22.24 57.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -79.82 -33.29 40.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.85 1.66 . . . . 0.0 110.969 179.088 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.8 mt -78.2 146.67 71.39 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 123.552 0.741 . . . . 0.0 112.66 177.541 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -73.7 174.6 12.0 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 C-N-CA 123.155 2.57 . . . . 0.0 113.18 -175.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.15 -50.56 15.92 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -179.384 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.78 -44.63 0.1 Allowed 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.77 -1.206 . . . . 0.0 109.493 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.286 31.2 tttt 84.57 38.33 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.901 2.48 . . . . 0.0 111.327 173.81 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.311 7.0 mpt_? . . . . . 0 C--O 1.259 1.556 0 N-CA-C 119.303 3.075 . . . . 0.0 119.303 177.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.259 13.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.204 1.478 . . . . 0.0 113.463 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -135.56 47.02 2.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.941 -2.349 . . . . 0.0 113.074 -177.627 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 42.1 mtt -80.24 161.11 25.33 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.881 -1.762 . . . . 0.0 113.524 174.685 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -176.26 -170.5 0.36 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 160.298 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.418 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.654 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -62.23 -30.35 71.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.55 -51.18 64.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.908 -1.12 . . . . 0.0 113.853 171.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -70.28 -36.41 74.37 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.184 1.394 . . . . 0.0 114.166 -178.209 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.98 -36.1 62.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.753 2.021 . . . . 0.0 115.364 177.231 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.32 -20.7 65.72 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.88 -18.77 60.87 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.016 1.326 . . . . 0.0 113.28 173.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 . . . . . 0 C--O 1.261 1.677 0 C-N-CA 131.164 3.786 . . . . 0.0 120.741 171.392 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.49 -1.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m 70.2 118.02 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.853 2.461 . . . . 0.0 115.402 172.596 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -95.46 -27.79 15.23 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.232 -1.542 . . . . 0.0 112.89 -173.512 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.286 67.2 m 83.4 59.64 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.901 2.48 . . . . 0.0 111.869 -173.414 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t -79.77 -51.32 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 127.697 2.399 . . . . 0.0 111.54 -178.464 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.498 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.436 HG21 ' HB3' ' B' ' 208' ' ' ALA . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.442 HG21 ' HB2' ' A' ' 61' ' ' GLU . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.67 HD13 HG23 ' B' ' 202' ' ' ILE . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -22.05 66.64 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -52.65 -53.92 40.48 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.068 2.147 . . . . 0.0 114.636 167.789 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -77.11 -16.63 59.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.794 -1.191 . . . . 0.0 113.363 -178.058 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -69.24 -46.26 67.79 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.145 -1.597 . . . . 0.0 113.113 168.105 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -73.92 -45.87 47.89 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.764 -1.21 . . . . 0.0 113.841 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.15 87.35 2.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.431 -1.418 . . . . 0.0 109.495 173.842 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -89.2 143.98 26.45 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 122.234 1.016 . . . . 0.0 110.142 179.119 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -99.59 14.34 30.34 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.936 1.294 . . . . 0.0 110.346 174.865 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -155.56 -111.94 0.4 Allowed Glycine 0 N--CA 1.43 -1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 111.504 173.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -101.04 165.57 13.96 Favored Pre-proline 0 N--CA 1.431 -1.419 0 O-C-N 120.918 -1.342 . . . . 0.0 109.525 -178.38 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -66.43 113.46 2.7 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 CA-C-N 122.461 1.915 . . . . 0.0 111.574 163.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -99.48 -163.26 1.02 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.901 0.88 . . . . 0.0 108.899 -178.758 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -93.13 -111.99 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 160.816 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.51 124.33 1.3 Allowed Glycine 0 N--CA 1.43 -1.716 0 O-C-N 120.017 -1.677 . . . . 0.0 110.354 172.456 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.285 13.1 ptt? 44.76 -113.16 0.33 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 157.125 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m -120.37 122.1 40.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.939 1.296 . . . . 0.0 110.248 152.044 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.442 ' HB2' HG21 ' A' ' 34' ' ' ILE . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.566 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 73' ' ' LEU . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -59.54 -32.15 70.06 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -89.05 -21.86 23.24 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 125.204 1.402 . . . . 0.0 112.703 -177.773 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.9 mt -100.82 156.46 35.14 Favored Pre-proline 0 N--CA 1.428 -1.528 0 O-C-N 120.142 -1.599 . . . . 0.0 112.47 -171.165 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -75.79 169.44 22.23 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 122.398 2.065 . . . . 0.0 111.115 169.265 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -72.88 -77.49 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.743 0.782 . . . . 0.0 111.91 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.5 -120.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.18 -2.526 . . . . 0.0 104.18 177.631 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.07 58.57 1.29 Allowed 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.819 1.295 . . . . 0.0 110.55 162.944 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? . . . . . 0 C--O 1.26 1.635 0 C-N-CA 125.308 1.443 . . . . 0.0 108.403 173.555 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -75.62 109.67 9.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.671 -1.893 . . . . 0.0 114.721 -172.049 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.276 2.5 ttt 57.23 69.08 0.77 Allowed 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 168.26 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -119.42 179.29 4.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.732 -1.23 . . . . 0.0 111.151 168.029 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.67 HG23 HD13 ' A' ' 35' ' ' LEU . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 208' ' ' ALA . . . . . 0.436 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -72.68 -24.61 61.04 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -58.57 -31.05 67.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.327 -1.483 . . . . 0.0 113.864 175.481 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -70.79 -41.48 71.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.79 2.436 . . . . 0.0 112.584 175.728 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.27 -22.93 47.55 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.11 -1.619 . . . . 0.0 113.258 -176.454 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -73.99 -19.76 60.55 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.904 -1.123 . . . . 0.0 113.397 166.702 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.59 -29.6 66.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.028 -1.67 . . . . 0.0 114.436 -179.172 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.259 1.58 0 N-CA-C 118.722 2.86 . . . . 0.0 118.722 160.516 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.26 69.4 m 83.59 96.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.217 2.607 . . . . 0.0 111.399 178.268 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -83.67 -69.93 0.6 Allowed 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.409 -0.807 . . . . 0.0 110.421 -176.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -101.01 101.41 12.18 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.231 1.967 . . . . 0.0 112.219 175.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t -75.03 -44.6 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 C-N-CA 127.346 2.258 . . . . 0.0 109.012 176.187 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.455 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.475 HG23 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.475 ' CE2' HG23 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HG3' HD13 ' A' ' 27' ' ' ILE . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.506 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.478 ' HB2' HG21 ' A' ' 58' ' ' VAL . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -56.23 6.17 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -55.1 -45.33 75.46 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.219 2.208 . . . . 0.0 113.435 -174.352 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -71.31 -20.54 62.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.635 1.974 . . . . 0.0 112.679 179.778 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -90.32 -1.68 57.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.764 -1.21 . . . . 0.0 112.906 179.08 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.23 -173.33 3.95 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.183 -1.573 . . . . 0.0 112.334 176.754 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -77.66 83.02 4.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.296 -1.503 . . . . 0.0 111.09 177.823 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.3 p -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.586 -1.322 . . . . 0.0 111.238 179.3 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.6 tttt -106.41 -29.89 9.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.971 0.908 . . . . 0.0 112.211 -163.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.05 -77.15 1.0 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 124.931 1.253 . . . . 0.0 111.467 176.073 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -68.75 158.11 86.71 Favored Pre-proline 0 N--CA 1.43 -1.463 0 C-N-CA 124.767 1.227 . . . . 0.0 113.317 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.84 154.1 58.67 Favored 'Trans proline' 0 N--CA 1.434 -2.002 0 CA-C-N 122.841 2.05 . . . . 0.0 112.625 176.534 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -79.2 162.41 25.75 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.544 1.164 . . . . 0.0 111.824 -177.581 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 68.4 mtm180 -139.23 -116.88 0.14 Allowed 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.472 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.48 93.94 0.87 Allowed Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 108.204 -1.958 . . . . 0.0 108.204 -167.643 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -149.94 0.07 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -178.568 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -96.34 147.24 24.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 -173.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.464 ' HB2' HD22 ' A' ' 80' ' ' LEU . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.5 ' HA ' HD13 ' A' ' 65' ' ' LEU . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.506 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CE1' HD11 ' B' ' 205' ' ' LEU . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -63.57 -35.76 81.55 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -132.02 22.03 4.52 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.337 0.655 . . . . 0.0 111.019 -176.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.464 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.297 19.8 mt -69.75 -87.93 0.02 OUTLIER Pre-proline 0 N--CA 1.43 -1.457 0 CA-C-O 115.921 -1.99 . . . . 0.0 114.781 161.376 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.13 151.93 55.86 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 CA-C-N 126.86 3.486 . . . . 0.0 113.402 -170.74 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -87.72 -36.17 17.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.783 1.233 . . . . 0.0 113.248 -169.479 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.6 -59.63 0.23 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -174.367 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -142.93 -44.74 0.3 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 168.123 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 . . . . . 0 C--O 1.26 1.655 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.371 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 CA--C 1.49 -1.35 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -105.83 145.8 30.73 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 109.142 173.086 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -70.0 140.16 52.87 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 121.159 -0.963 . . . . 0.0 113.35 174.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -174.48 -168.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 -172.947 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 205' ' ' LEU . . . . . 0.403 HD11 ' CE1' ' A' ' 76' ' ' PHE . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -53.58 -27.14 24.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -61.47 -33.44 73.77 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.264 1.426 . . . . 0.0 113.745 173.366 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -78.0 -26.68 48.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.178 1.391 . . . . 0.0 111.363 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -74.89 -35.1 62.28 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 119.715 -1.866 . . . . 0.0 112.083 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -71.06 -18.36 62.56 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.746 2.018 . . . . 0.0 114.172 175.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -68.76 -46.59 68.41 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.725 -1.235 . . . . 0.0 111.809 179.619 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.265 57.2 m80 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 127.578 2.351 . . . . 0.0 114.299 174.758 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 m -87.45 113.3 23.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.712 1.244 . . . . 0.0 114.266 -158.862 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -83.94 -31.9 25.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.591 2.756 . . . . 0.0 113.064 -178.471 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -83.88 40.14 0.73 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.094 1.887 . . . . 0.0 116.094 -169.337 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.28 -56.41 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 126.353 1.861 . . . . 0.0 112.494 -178.165 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 33.9 m170 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' B' ' 206' ' ' LEU . 2.0 tm0? -65.49 -30.43 71.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -60.29 -55.61 31.57 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.23 1.812 . . . . 0.0 112.672 172.661 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -58.81 -35.66 73.22 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.672 1.189 . . . . 0.0 114.163 178.406 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.34 -26.86 68.22 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.53 1.932 . . . . 0.0 115.146 174.657 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.3 mt -81.94 149.55 28.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.511 -1.993 . . . . 0.0 113.594 179.653 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 74.63 42.08 0.31 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.613 1.965 . . . . 0.0 113.536 169.381 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 p -80.12 163.59 24.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.09 -1.006 . . . . 0.0 111.224 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -76.94 -1.67 29.78 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.242 -1.536 . . . . 0.0 114.329 175.745 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.12 -63.57 0.28 Allowed Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.813 -1.18 . . . . 0.0 111.679 175.377 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 28.3 ptt-85 -72.26 155.88 91.08 Favored Pre-proline 0 N--CA 1.43 -1.458 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -170.935 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -74.51 112.95 3.67 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.63 2.22 . . . . 0.0 111.789 168.268 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.48 158.67 41.69 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 -178.707 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.317 87.5 mtt-85 85.65 126.87 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 124.764 2.221 . . . . 0.0 116.06 168.148 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 132.16 138.82 4.21 Favored Glycine 0 N--CA 1.43 -1.724 0 N-CA-C 104.357 -3.497 . . . . 0.0 104.357 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -80.82 -161.58 0.4 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.116 -1.226 . . . . 0.0 110.14 174.571 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m -66.7 130.6 43.71 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.701 -1.874 . . . . 0.0 113.063 -175.409 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' HB2' HD22 ' A' ' 80' ' ' LEU . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 65' ' ' LEU 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.0 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.28 -17.94 59.22 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -86.72 -7.29 58.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.029 1.332 . . . . 0.0 110.612 172.017 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.41 HD22 ' HB2' ' A' ' 55' ' ' GLU . 52.4 mt -112.06 175.1 2.0 Allowed Pre-proline 0 N--CA 1.431 -1.417 0 C-N-CA 124.873 1.269 . . . . 0.0 110.558 176.801 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -65.83 -63.68 0.06 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.973 0 C-N-CA 122.302 2.001 . . . . 0.0 114.709 167.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.95 -121.59 0.28 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.388 1.075 . . . . 0.0 110.627 -178.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -167.47 -36.19 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.272 -1.518 . . . . 0.0 111.461 -173.368 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.271 3.4 mptp? 79.52 -0.43 2.21 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.425 2.29 . . . . 0.0 114.945 -179.319 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.302 0.0 OUTLIER . . . . . 0 C--O 1.26 1.618 0 C-N-CA 128.028 2.531 . . . . 0.0 114.768 -177.478 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 CA--C 1.49 -1.328 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 34.5 mtm105 -141.45 166.92 23.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.247 -1.533 . . . . 0.0 112.603 -168.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 8.3 mmm -63.66 115.01 4.34 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.18 1.392 . . . . 0.0 113.867 178.248 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -127.8 174.73 8.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 170.248 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -70.38 -41.54 72.93 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -64.95 -41.24 95.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.651 1.18 . . . . 0.0 113.634 173.065 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -64.11 -36.89 85.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.532 -1.355 . . . . 0.0 113.808 177.567 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.87 -42.11 97.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 169.957 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.6 -20.25 65.5 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -71.08 -57.84 4.14 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.19 -0.944 . . . . 0.0 112.183 170.656 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 29.1 m170 . . . . . 0 C--O 1.26 1.628 0 C-N-CA 126.311 1.844 . . . . 0.0 114.424 -169.19 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 120.793 0.33 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 p -158.53 134.74 9.23 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.742 -1.224 . . . . 0.0 110.407 170.629 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -90.73 -47.68 7.5 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.279 -0.888 . . . . 0.0 110.133 169.954 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.4 m 68.78 66.98 0.3 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.838 1.78 . . . . 0.0 112.479 176.451 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -67.9 -51.4 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 129.262 3.025 . . . . 0.0 110.87 -175.125 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.487 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.487 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.409 HG23 HD23 ' A' ' 65' ' ' LEU . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HB2' HD21 ' B' ' 206' ' ' LEU . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.553 ' HB2' ' HE2' ' A' ' 53' ' ' MET . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -19.52 65.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -45.3 -31.71 1.69 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.331 2.652 . . . . 0.0 115.823 166.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -44.02 33.99 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.444 2.298 . . . . 0.0 116.23 174.129 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -82.77 -30.73 28.73 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 121.975 0.893 . . . . 0.0 112.0 -177.852 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.1 mt -71.07 -25.52 62.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -172.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.25 -76.24 0.08 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.975 -1.078 . . . . 0.0 111.722 168.191 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -176.1 154.2 1.39 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.704 1.201 . . . . 0.0 108.165 -176.067 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -99.76 170.08 8.8 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.298 1.439 . . . . 0.0 111.225 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.43 -27.85 14.25 Favored Glycine 0 N--CA 1.429 -1.771 0 O-C-N 119.955 -1.716 . . . . 0.0 113.507 170.366 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -89.23 164.54 30.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 125.611 1.564 . . . . 0.0 111.789 -177.851 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -59.18 133.39 52.57 Favored 'Trans proline' 0 N--CA 1.433 -2.043 0 C-N-CA 123.241 2.628 . . . . 0.0 114.754 178.064 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 136.24 35.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.559 2.429 . . . . 0.0 117.559 -161.822 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.3 mmt-85 -99.82 -21.66 15.65 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.469 1.508 . . . . 0.0 111.615 176.265 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.09 50.78 3.11 Favored Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 115.896 1.118 . . . . 0.0 115.896 -178.198 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.553 ' HE2' ' HB2' ' A' ' 38' ' ' TYR . 23.6 ptt? 33.73 -137.28 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.513 3.525 . . . . 0.0 118.785 155.808 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m -106.25 131.49 53.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.487 1.115 . . . . 0.0 109.871 169.278 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 35' ' ' LEU . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 HG23 ' A' ' 27' ' ' ILE . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -72.91 -23.97 60.77 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -81.57 -30.45 33.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.127 1.371 . . . . 0.0 110.772 179.133 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -84.43 150.02 56.22 Favored Pre-proline 0 N--CA 1.43 -1.454 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -177.637 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.68 147.67 25.05 Favored 'Trans proline' 0 C--N 1.299 -2.055 0 C-N-CA 122.418 2.079 . . . . 0.0 112.667 175.937 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -77.3 -46.11 24.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 176.372 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.52 -60.7 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 175.492 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -163.39 71.56 0.26 Allowed 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.176 0.989 . . . . 0.0 110.715 175.198 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.604 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -176.348 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.49 -1.345 0 CA-C-O 122.062 0.934 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 67.7 mtt-85 -142.82 -171.06 3.37 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.742 -1.849 . . . . 0.0 109.209 174.152 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.0 mtt -73.48 -107.4 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.605 -1.31 . . . . 0.0 112.44 167.008 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 71.7 178.21 0.25 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.792 2.437 . . . . 0.0 110.943 -168.995 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 35' ' ' LEU . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -53.27 -34.07 55.71 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -69.05 -29.91 68.15 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.673 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -80.08 -39.36 29.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.408 1.483 . . . . 0.0 110.252 172.698 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -58.1 -46.8 84.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.731 1.612 . . . . 0.0 114.895 176.559 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.74 -19.18 37.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.606 2.362 . . . . 0.0 116.795 179.503 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.79 -35.73 79.17 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.066 -1.021 . . . . 0.0 113.309 177.453 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 26.7 p80 . . . . . 0 C--O 1.26 1.654 0 C-N-CA 124.445 1.098 . . . . 0.0 111.707 -174.447 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 CA--C 1.49 -1.355 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 74.64 139.76 0.06 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.389 2.276 . . . . 0.0 114.785 169.929 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.29 112.76 24.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.271 -1.518 . . . . 0.0 109.522 176.741 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -132.7 34.22 3.68 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.139 1.376 . . . . 0.0 109.855 -174.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t -56.72 -55.83 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 128.61 2.764 . . . . 0.0 112.264 -179.499 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.496 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.684 HD13 HG23 ' B' ' 202' ' ' ILE . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.805 ' HG2' HD12 ' B' ' 206' ' ' LEU 0.319 0.0 OUTLIER -77.6 -15.9 58.93 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 4 4 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -38.98 -39.46 0.54 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 129.806 3.242 . . . . 0.0 118.345 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.89 -28.39 16.01 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 128.366 2.667 . . . . 0.0 115.639 176.342 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -81.16 -21.7 39.55 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.636 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -60.66 -45.9 92.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -173.282 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.55 60.5 1.01 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.551 -1.343 . . . . 0.0 110.259 164.503 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.5 t -81.14 145.82 30.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.028 -1.045 . . . . 0.0 110.968 172.678 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -132.04 -110.8 0.24 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 178.241 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -101.82 31.59 8.5 Favored Glycine 0 N--CA 1.43 -1.723 0 O-C-N 120.745 -1.222 . . . . 0.0 113.313 -178.418 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -84.8 154.08 61.14 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 121.525 -0.985 . . . . 0.0 109.822 174.984 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.76 169.45 22.34 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 121.894 1.729 . . . . 0.0 111.05 161.189 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -72.84 135.69 45.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.046 0.927 . . . . 0.0 111.73 178.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -100.09 -104.83 0.23 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 123.769 0.828 . . . . 0.0 112.867 178.067 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.51 -155.33 53.37 Favored Glycine 0 N--CA 1.431 -1.668 0 O-C-N 119.769 -1.832 . . . . 0.0 111.531 -168.052 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -156.53 -138.55 0.07 Allowed 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.245 -1.15 . . . . 0.0 109.363 -164.772 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m -86.92 122.14 30.37 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 162.544 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.444 ' HA ' HD13 ' A' ' 65' ' ' LEU . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 62' ' ' VAL . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -65.66 -29.31 69.85 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -83.33 -23.37 32.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.95 -1.094 . . . . 0.0 111.422 178.859 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -95.42 162.23 25.23 Favored Pre-proline 0 N--CA 1.43 -1.446 0 C-N-CA 124.074 0.949 . . . . 0.0 111.768 -177.276 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -72.43 162.37 41.66 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 CA-C-N 122.633 1.976 . . . . 0.0 114.186 -174.902 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -91.51 -39.11 12.12 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 121.371 -0.831 . . . . 0.0 111.795 164.013 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -151.05 -123.6 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.027 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -121.23 -82.48 0.65 Allowed 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 153.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.3 mtt-85 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 124.733 1.213 . . . . 0.0 110.024 171.318 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.26 14.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.283 1.516 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -85.9 162.34 18.63 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.605 -1.934 . . . . 0.0 111.637 178.154 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 34.8 mmm -75.3 75.78 2.41 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.57 -1.332 . . . . 0.0 113.709 176.816 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -111.37 176.07 5.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.218 1.407 . . . . 0.0 107.8 169.81 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 202' ' ' ILE . . . . . 0.684 HG23 HD13 ' A' ' 35' ' ' LEU . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 206' ' ' LEU . . . . . 0.805 HD12 ' HG2' ' A' ' 39' ' ' GLN 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -69.2 -28.08 66.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.64 -26.74 64.56 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.224 -1.548 . . . . 0.0 113.644 170.011 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -26.4 68.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.249 -1.532 . . . . 0.0 113.067 175.463 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.76 -36.28 80.22 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.014 -1.679 . . . . 0.0 113.452 170.332 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.88 -19.11 64.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.628 -1.295 . . . . 0.0 113.233 173.573 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -74.5 -17.75 60.71 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 177.678 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 . . . . . 0 C--O 1.26 1.607 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -177.375 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.422 HG12 ' H ' ' A' ' 27' ' ' ILE . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 122.169 0.985 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 . . . . . 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.462 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.462 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 72' ' ' LEU . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.473 ' HG3' HD13 ' A' ' 27' ' ' ILE . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.567 HD13 ' HB3' ' A' ' 61' ' ' GLU . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p . . . . . 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 62' ' ' VAL 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.567 ' HB3' HD13 ' A' ' 34' ' ' ILE . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.65 ' HA ' HD23 ' A' ' 65' ' ' LEU . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 62' ' ' VAL . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.413 HD13 HG12 ' A' ' 17' ' ' ILE . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.704 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t . . . . . 0 N--CA 1.43 -1.447 0 CA-C-O 122.791 1.281 . . . . 0.0 111.463 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.474 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.474 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 . . . . . 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 121.085 0.469 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . 0.442 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 115.99 1.848 . . . . 0.0 115.99 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.433 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 61.9 m . . . . . 0 N--CA 1.43 -1.431 0 CA-C-O 122.3 1.048 . . . . 0.0 109.84 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 65' ' ' LEU 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 . . . . . 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.414 HG23 HD13 ' A' ' 35' ' ' LEU 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t . . . . . 0 N--CA 1.43 -1.446 0 CA-C-O 122.785 1.279 . . . . 0.0 108.04 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE2' HD11 ' A' ' 17' ' ' ILE . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 14' ' ' VAL . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.426 HD11 ' CE2' ' A' ' 13' ' ' TYR . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 61' ' ' GLU . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.667 HD13 HG23 ' B' ' 202' ' ' ILE . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.429 -1.475 0 CA-C-O 121.873 0.844 . . . . 0.0 110.383 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 34' ' ' ILE . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HA ' HD13 ' A' ' 65' ' ' LEU . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 . . . . . 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.731 0.777 . . . . 0.0 112.816 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.667 HG23 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 N--CA 1.431 -1.418 0 CA-C-O 122.374 1.083 . . . . 0.0 113.514 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.415 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.507 HD13 HG23 ' B' ' 202' ' ' ILE . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.547 ' HG2' HD23 ' B' ' 206' ' ' LEU 0.332 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p . . . . . 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.55 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 . . . . . 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.507 HG23 HD13 ' A' ' 35' ' ' LEU . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 39' ' ' GLN . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t . . . . . 0 N--CA 1.429 -1.485 0 CA-C-O 121.753 0.787 . . . . 0.0 112.848 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.445 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.534 HD13 HG23 ' B' ' 202' ' ' ILE . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.429 -1.487 0 CA-C-O 121.217 0.532 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.498 ' HA ' HD13 ' A' ' 65' ' ' LEU . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 . . . . . 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-O 121.631 0.729 . . . . 0.0 112.856 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.534 HG23 HD13 ' A' ' 35' ' ' LEU . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 . . . . . 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t . . . . . 0 N--CA 1.43 -1.449 0 CA-C-O 123.027 1.394 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.679 HG22 HG23 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.407 ' CE1' HD12 ' B' ' 206' ' ' LEU . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m . . . . . 0 N--CA 1.43 -1.473 0 CA-C-O 122.135 0.969 . . . . 0.0 110.674 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.679 HG23 HG22 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.542 ' O ' HD12 ' A' ' 65' ' ' LEU 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.451 HG21 HD21 ' A' ' 35' ' ' LEU . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.542 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 N--CA 1.429 -1.49 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.621 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 . . . . . 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.481 1.134 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.495 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' HD13 ' A' ' 27' ' ' ILE . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 121.8 0.81 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.49 ' HA ' HD13 ' A' ' 65' ' ' LEU . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.415 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 . . . . . 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 N--CA 1.431 -1.384 0 N-CA-C 113.323 0.861 . . . . 0.0 113.323 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.456 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.521 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 . . . . . 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t . . . . . 0 N--CA 1.431 -1.421 0 CA-C-O 122.278 1.037 . . . . 0.0 110.022 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.413 ' CE1' HD11 ' A' ' 11' ' ' ILE . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 7' ' ' PHE . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.533 HG23 HD23 ' A' ' 65' ' ' LEU . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.734 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.066 0.46 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 65' ' ' LEU . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.533 HD23 HG23 ' A' ' 27' ' ' ILE . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 . . . . . 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.579 HG23 HD13 ' A' ' 35' ' ' LEU . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.734 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t . . . . . 0 N--CA 1.43 -1.43 0 CA-C-O 123.201 1.476 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.419 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.427 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 83.3 m-70 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 N--CA 1.429 -1.494 0 CA-C-O 122.06 0.934 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.43 -1.446 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 . . . . . 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.1 t . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 91.7 m-70 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.647 1.213 . . . . 0.0 109.02 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 65' ' ' LEU . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 202' ' ' ILE . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 . . . . . 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 N--CA 1.431 -1.408 0 CA-C-O 121.138 0.494 . . . . 0.0 111.071 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.463 HD11 ' CZ ' ' A' ' 76' ' ' PHE 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 . . . . . 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t . . . . . 0 N--CA 1.429 -1.491 0 CA-C-O 123.448 1.594 . . . . 0.0 111.549 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HG3' HD13 ' A' ' 27' ' ' ILE . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.506 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.588 HD12 HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.506 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 71.6 m-70 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.9 p . . . . . 0 N--CA 1.431 -1.424 0 CA-C-O 122.726 1.251 . . . . 0.0 110.983 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' HD13 ' A' ' 65' ' ' LEU . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 62' ' ' VAL . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.494 HG23 HD13 ' A' ' 35' ' ' LEU 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.588 HD21 HD12 ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 . . . . . 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.431 -1.425 0 CA-C-O 122.641 1.21 . . . . 0.0 109.578 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.491 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 14' ' ' VAL . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.414 ' HG2' HD23 ' B' ' 206' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.429 -1.513 0 CA-C-O 121.025 0.441 . . . . 0.0 110.015 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' HD12 ' A' ' 65' ' ' LEU . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.409 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 . . . . . 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 . . . . . 0 N--CA 1.431 -1.418 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 . . . . . 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t . . . . . 0 N--CA 1.43 -1.458 0 CA-C-O 122.342 1.067 . . . . 0.0 112.038 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.517 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HG3' HD13 ' A' ' 27' ' ' ILE . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.512 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 61' ' ' GLU . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB2' HD11 ' B' ' 206' ' ' LEU . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 84.4 m-70 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? . . . . . 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.43 -1.45 0 CA-C-O 122.297 1.046 . . . . 0.0 109.164 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HB3' HD13 ' A' ' 34' ' ' ILE . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 65' ' ' LEU . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 . . . . . 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t . . . . . 0 N--CA 1.431 -1.419 0 CA-C-O 123.198 1.475 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.439 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.681 HD13 HG23 ' B' ' 202' ' ' ILE . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m . . . . . 0 N--CA 1.431 -1.409 0 CA-C-O 122.187 0.994 . . . . 0.0 112.644 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 65' ' ' LEU . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.59 1.186 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 35' ' ' LEU . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 35' ' ' LEU . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 123.09 1.424 . . . . 0.0 108.125 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.434 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.651 HD13 HG23 ' B' ' 202' ' ' ILE . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 N--CA 1.431 -1.414 0 CA-C-O 121.936 0.874 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' HD23 ' A' ' 65' ' ' LEU . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 62' ' ' VAL . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 . . . . . 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.651 HG23 HD13 ' A' ' 35' ' ' LEU . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.438 HD21 HD12 ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 . . . . . 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.275 1.512 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.456 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.496 HG21 ' HB2' ' A' ' 61' ' ' GLU . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.447 HD11 HD22 ' B' ' 205' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.078 0.466 . . . . 0.0 111.338 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HB2' HG21 ' A' ' 34' ' ' ILE . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 122.913 1.339 . . . . 0.0 110.945 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 35' ' ' LEU 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.447 HD22 HD11 ' A' ' 35' ' ' LEU . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t . . . . . 0 N--CA 1.429 -1.489 0 CA-C-O 122.71 1.243 . . . . 0.0 109.832 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.454 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.621 HD13 HG23 ' B' ' 202' ' ' ILE . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? . . . . . 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p . . . . . 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 65' ' ' LEU . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 . . . . . 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.429 -1.5 0 N-CA-C 103.708 -2.701 . . . . 0.0 103.708 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.621 HG23 HD13 ' A' ' 35' ' ' LEU . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? . . . . . 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t . . . . . 0 N--CA 1.43 -1.464 0 CA-C-O 123.057 1.408 . . . . 0.0 112.633 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.463 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 . . . . . 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 . . . . . 0 N--CA 1.431 -1.396 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.609 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 . . . . . 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.429 -1.51 0 CA-C-O 122.624 1.202 . . . . 0.0 109.94 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 27' ' ' ILE . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.645 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p . . . . . 0 N--CA 1.432 -1.373 0 CA-C-O 122.517 1.151 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 61' ' ' GLU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 . . . . . 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 . . . . . 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 . . . . . 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t . . . . . 0 N--CA 1.431 -1.42 0 CA-C-O 122.055 0.931 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.482 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.445 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.563 HD13 HG23 ' B' ' 202' ' ' ILE . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.43 -1.433 0 CA-C-O 121.062 0.458 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.412 ' HA ' HD13 ' A' ' 65' ' ' LEU . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 . . . . . 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.462 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.563 HG23 HD13 ' A' ' 35' ' ' LEU . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 . . . . . 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t . . . . . 0 N--CA 1.43 -1.466 0 CA-C-O 122.977 1.37 . . . . 0.0 111.623 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.475 ' HA ' HD13 ' A' ' 65' ' ' LEU . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 62' ' ' VAL . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 . . . . . 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 . . . . . 0 N--CA 1.43 -1.474 0 CA-C-O 121.638 0.732 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.65 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 122.19 0.995 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.466 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.457 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.608 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.507 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' A' ' 65' ' ' LEU . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 ' O ' ' A' ' 61' ' ' GLU . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 . . . . . 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 . . . . . 0 N--CA 1.43 -1.466 0 N-CA-C 104.963 -2.236 . . . . 0.0 104.963 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.608 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 . . . . . 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.43 -1.443 0 CA-C-O 122.982 1.372 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' B' ' 206' ' ' LEU . 93.1 m-70 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.513 ' HB2' HG21 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? . . . . . 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.43 -1.444 0 CA-C-O 121.474 0.654 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 65' ' ' LEU 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CE1' HD11 ' B' ' 202' ' ' ILE . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 . . . . . 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 . . . . . 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.418 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.654 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 123.172 1.463 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.498 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.436 HG21 ' HB3' ' B' ' 208' ' ' ALA . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.442 HG21 ' HB2' ' A' ' 61' ' ' GLU . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.67 HD13 HG23 ' B' ' 202' ' ' ILE . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 N--CA 1.43 -1.467 0 CA-C-O 121.882 0.849 . . . . 0.0 110.248 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.449 ' HA ' HD22 ' A' ' 64' ' ' ASN . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.566 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.449 HD22 ' HA ' ' A' ' 61' ' ' GLU 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 4 4 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 73' ' ' LEU . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 . . . . . 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 . . . . . 0 N--CA 1.43 -1.448 0 CA-C-O 121.697 0.76 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.67 HG23 HD13 ' A' ' 35' ' ' LEU . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . 0.436 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 . . . . . 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t . . . . . 0 N--CA 1.431 -1.399 0 CA-C-O 122.582 1.182 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.455 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.475 HG23 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.475 ' CE2' HG23 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HG3' HD13 ' A' ' 27' ' ' ILE . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.506 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.478 ' HB2' HG21 ' A' ' 58' ' ' VAL . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.5 ' HA ' HD13 ' A' ' 65' ' ' LEU . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.506 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CE1' HD11 ' B' ' 205' ' ' LEU . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 . . . . . 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 . . . . . 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . 0.403 HD11 ' CE1' ' A' ' 76' ' ' PHE . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? . . . . . 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t . . . . . 0 N--CA 1.43 -1.47 0 CA-C-O 121.845 0.831 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.402 ' CE1' HD12 ' B' ' 206' ' ' LEU . 87.9 m-70 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' B' ' 206' ' ' LEU . 2.0 tm0? . . . . . 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 122.206 1.003 . . . . 0.0 113.063 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 65' ' ' LEU 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.1 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 . . . . . 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 . . . . . 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 . . . . . 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t . . . . . 0 N--CA 1.43 -1.442 0 CA-C-O 122.616 1.198 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.487 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.487 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.409 HG23 HD23 ' A' ' 65' ' ' LEU . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HB2' HD21 ' B' ' 206' ' ' LEU . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.429 -1.49 0 CA-C-O 121.152 0.501 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 35' ' ' LEU . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 HG23 ' A' ' 27' ' ' ILE . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 . . . . . 0 N--CA 1.431 -1.406 0 CA-C-O 120.881 0.372 . . . . 0.0 110.943 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 35' ' ' LEU . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 . . . . . 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t . . . . . 0 N--CA 1.43 -1.469 0 CA-C-O 122.703 1.239 . . . . 0.0 112.264 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.496 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.684 HD13 HG23 ' B' ' 202' ' ' ILE . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.805 ' HG2' HD12 ' B' ' 206' ' ' LEU 0.319 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m . . . . . 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.444 ' HA ' HD13 ' A' ' 65' ' ' LEU . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 62' ' ' VAL . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 . . . . . 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 . . . . . 0 N--CA 1.43 -1.43 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 202' ' ' ILE . . . . . 0.684 HG23 HD13 ' A' ' 35' ' ' LEU . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 206' ' ' LEU . . . . . 0.805 HD12 ' HG2' ' A' ' 39' ' ' GLN 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 . . . . . 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 52.3 mp0 . . . . . 0 CA--C 1.49 -1.346 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.265 19.6 m 83.1 123.68 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.293 2.237 . . . . 0.0 114.466 173.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -84.76 113.53 21.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.313 1.445 . . . . 0.0 111.96 -177.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 54.0 m -142.42 26.11 1.82 Allowed 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 122.75 1.262 . . . . 0.0 111.666 177.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.4 t -67.86 -47.41 79.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.593 1.663 . . . . 0.0 109.674 176.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -75.16 -20.32 59.41 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -176.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -62.91 -46.4 88.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.398 1.079 . . . . 0.0 109.575 166.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 94.1 m-20 -74.32 -28.53 61.21 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.126 1.37 . . . . 0.0 110.593 -176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -63.57 -34.04 76.93 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.882 -1.136 . . . . 0.0 112.191 169.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.92 69.51 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 121.063 -1.023 . . . . 0.0 112.811 169.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.2 mm -57.4 -51.36 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.336 -1.478 . . . . 0.0 113.137 176.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.9 m -56.2 -34.85 66.65 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.491 1.516 . . . . 0.0 114.001 177.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.2 t80 -68.87 -54.04 17.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.242 1.417 . . . . 0.0 112.319 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 50.3 t -58.46 -44.25 88.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 C-N-CA 125.625 1.57 . . . . 0.0 112.813 177.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -61.6 -37.52 84.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.846 1.424 . . . . 0.0 114.846 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 89.0 tttt -64.49 -42.91 95.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.505 -1.997 . . . . 0.0 112.861 172.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.4 mt -57.8 -49.98 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.784 2.034 . . . . 0.0 110.743 173.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.8 pttp -64.97 -33.15 75.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.7 m -77.19 -32.93 56.41 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.24 1.416 . . . . 0.0 112.905 177.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -82.4 -31.62 29.53 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 118.456 -2.653 . . . . 0.0 113.992 174.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -87.93 55.83 3.62 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.846 -1.159 . . . . 0.0 113.499 173.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.2 mt -87.4 -28.85 21.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.274 -1.516 . . . . 0.0 112.23 169.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.38 -19.07 61.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.287 1.041 . . . . 0.0 111.414 171.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -128.2 81.7 69.96 Favored Pre-proline 0 N--CA 1.43 -1.466 0 C-N-CA 124.64 1.176 . . . . 0.0 109.927 -172.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.36 -5.16 15.42 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 123.146 2.564 . . . . 0.0 112.652 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -80.43 -30.2 37.65 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.081 1.752 . . . . 0.0 112.379 -172.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.422 HG12 ' H ' ' A' ' 27' ' ' ILE . 3.8 mm -59.1 -34.05 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.016 2.126 . . . . 0.0 112.238 -177.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -19.23 63.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.4 1.88 . . . . 0.0 114.418 175.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmt85 -78.02 -60.73 2.25 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.966 -1.708 . . . . 0.0 111.634 166.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.4 p -79.06 -31.38 44.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -162.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -51.14 -55.38 18.11 Favored 'General case' 0 CA--C 1.489 -1.4 0 C-N-CA 125.615 1.566 . . . . 0.0 113.093 175.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.449 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -74.28 -37.81 63.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.65 -1.281 . . . . 0.0 112.082 -176.321 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -46.36 -41.39 13.43 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.269 1.828 . . . . 0.0 115.336 169.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -67.22 -47.21 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.652 1.581 . . . . 0.0 112.503 171.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.6 mt -68.7 -17.8 64.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 118.384 -2.697 . . . . 0.0 114.262 175.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.1 m170 -66.97 -24.3 66.04 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 118.954 -2.342 . . . . 0.0 113.581 173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 m -68.15 -35.19 77.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.333 1.853 . . . . 0.0 110.76 168.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -67.29 -61.19 2.03 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.326 1.45 . . . . 0.0 112.467 173.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.62 -19.08 65.18 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.684 1.994 . . . . 0.0 115.852 -168.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 71.7 tttt -43.74 -40.45 4.3 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 129.507 3.123 . . . . 0.0 116.817 177.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.6 pp20? -40.01 -50.15 2.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.832 2.853 . . . . 0.0 117.393 177.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -58.38 -32.14 68.3 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.999 1.72 . . . . 0.0 115.524 179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.5 mt -103.34 -9.38 19.52 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.594 -1.317 . . . . 0.0 112.14 -179.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -80.84 -39.93 25.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.96 1.304 . . . . 0.0 111.666 -174.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.3 p -81.74 166.54 19.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.251 1.02 . . . . 0.0 111.828 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -110.7 56.21 0.64 Allowed 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.211 -1.556 . . . . 0.0 107.201 165.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 169.47 -99.6 0.15 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.774 -1.204 . . . . 0.0 113.315 -174.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.3 ptp180 -86.99 153.66 54.68 Favored Pre-proline 0 N--CA 1.43 -1.434 0 N-CA-C 115.053 1.501 . . . . 0.0 115.053 -165.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -75.0 167.72 26.43 Favored 'Trans proline' 0 C--N 1.3 -2.022 0 C-N-CA 122.904 2.403 . . . . 0.0 113.651 168.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -137.39 -161.36 1.16 Allowed 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.835 -1.166 . . . . 0.0 109.944 -178.359 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -102.92 -12.68 17.33 Favored 'General case' 0 N--CA 1.428 -1.527 0 O-C-N 120.138 -1.601 . . . . 0.0 113.185 177.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.3 -89.63 1.63 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.981 -1.074 . . . . 0.0 110.475 -173.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.3 -147.65 0.22 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.31 1.444 . . . . 0.0 108.412 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.1 p -91.25 131.25 36.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.454 -1.404 . . . . 0.0 110.419 167.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.3 pm0 -59.09 -27.02 65.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.052 1.741 . . . . 0.0 113.945 -176.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.27 -25.47 65.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 116.392 1.997 . . . . 0.0 116.392 169.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -83.83 -40.16 19.04 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 118.998 -2.314 . . . . 0.0 109.768 -174.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.93 -35.4 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 122.451 1.119 . . . . 0.0 110.755 -174.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -56.25 -55.68 30.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.65 1.98 . . . . 0.0 113.496 162.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.13 -41.63 62.68 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.025 1.73 . . . . 0.0 114.961 -175.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -71.22 -56.39 6.15 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 118.703 -0.665 . . . . 0.0 110.607 -179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 84.8 t -48.72 -32.39 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 C-N-CA 127.24 2.216 . . . . 0.0 115.347 178.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.74 -34.85 79.13 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.136 1.374 . . . . 0.0 112.606 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -76.57 -30.68 57.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.698 -1.251 . . . . 0.0 112.104 -177.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.0 mp -64.92 -47.3 78.22 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.917 2.087 . . . . 0.0 112.915 172.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -88.02 -14.78 38.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.747 1.219 . . . . 0.0 111.513 -165.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -35.34 127.51 0.58 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 130.3 3.44 . . . . 0.0 118.275 -165.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.93 -42.71 1.85 Allowed Glycine 0 N--CA 1.43 -1.737 0 C-N-CA 125.453 1.501 . . . . 0.0 110.02 -165.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -98.76 97.9 9.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.388 -1.654 . . . . 0.0 112.868 -178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -79.5 -24.15 42.49 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.896 1.278 . . . . 0.0 111.588 177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -67.38 -28.62 68.09 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.583 2.353 . . . . 0.0 113.069 -176.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 84.3 mt -68.56 -43.23 77.08 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.32 -1.487 . . . . 0.0 113.017 170.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.11 -18.55 63.98 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.13 -2.231 . . . . 0.0 113.157 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 6.1 t -60.97 -50.47 73.24 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.844 1.257 . . . . 0.0 112.132 170.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.68 -20.96 62.64 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 173.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -64.39 -28.63 69.82 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.96 -1.087 . . . . 0.0 111.966 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -64.5 -18.98 64.15 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 126.433 1.968 . . . . 0.0 115.058 -178.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -71.85 -35.29 69.8 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.85 1.26 . . . . 0.0 112.501 175.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -88.82 -2.94 58.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.643 1.577 . . . . 0.0 110.159 -174.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 74.3 mt -99.56 106.88 42.52 Favored Pre-proline 0 N--CA 1.43 -1.459 0 CA-C-O 118.687 -0.673 . . . . 0.0 110.578 169.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -77.36 92.11 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.978 0 C-N-CA 122.273 1.982 . . . . 0.0 112.506 178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -100.9 -87.28 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.513 -0.742 . . . . 0.0 112.655 174.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -118.53 -39.22 3.03 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.282 -0.886 . . . . 0.0 109.617 -165.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.7 tttp 72.27 65.81 0.13 Allowed 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.824 2.45 . . . . 0.0 112.139 177.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? . . . . . 0 C--O 1.26 1.626 0 C-N-CA 124.632 1.173 . . . . 0.0 110.254 178.504 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 CA--C 1.489 -1.375 0 CA-C-O 122.03 0.919 . . . . 0.0 112.184 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 72.0 mtm180 -117.5 43.16 2.42 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.023 -1.673 . . . . 0.0 111.516 -173.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 43.1 mtp -84.76 84.39 7.7 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.94 -1.725 . . . . 0.0 111.669 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -122.96 173.32 7.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 172.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.275 1.6 mt -63.94 -21.58 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 O-C-N 119.893 -1.754 . . . . 0.0 113.931 -177.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -32.97 1.33 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.347 1.98 . . . . 0.0 116.347 165.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 31.0 mmm -63.94 -29.27 70.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.329 1.452 . . . . 0.0 113.8 176.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 41.7 mt -74.15 -32.73 63.25 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -80.24 -20.65 44.06 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.493 1.117 . . . . 0.0 110.616 174.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -80.8 -52.45 7.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 120.414 -1.429 . . . . 0.0 109.965 177.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.24 74.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 125.239 1.416 . . . . 0.0 114.629 174.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.75 -50.77 67.76 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 174.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.16 -34.98 77.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.093 -1.629 . . . . 0.0 112.54 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -54.27 -53.8 48.78 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.978 1.711 . . . . 0.0 113.332 167.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.7 mt -69.37 -31.34 69.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 -177.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.96 -48.38 80.13 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.034 1.333 . . . . 0.0 112.893 169.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 23.9 ttm105 -71.37 -31.75 67.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.498 2.319 . . . . 0.0 113.64 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -60.72 -39.75 89.75 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.434 1.893 . . . . 0.0 114.996 174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -62.71 -40.0 95.79 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.524 -1.36 . . . . 0.0 112.585 176.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -72.92 -28.48 62.48 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.254 1.422 . . . . 0.0 113.881 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -65.08 -42.2 94.34 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 126.425 1.89 . . . . 0.0 111.769 171.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.08 -25.12 65.18 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.655 2.094 . . . . 0.0 116.655 -171.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.77 -46.22 63.33 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.884 -1.135 . . . . 0.0 114.052 -175.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 125.853 1.661 . . . . 0.0 115.03 -179.683 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 . . . . . 0 CA--C 1.489 -1.378 0 CA-C-O 121.195 0.521 . . . . 0.0 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 p -147.24 125.34 12.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.525 -1.359 . . . . 0.0 109.198 165.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -125.71 -42.82 1.9 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 123.776 0.831 . . . . 0.0 112.27 -173.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.4 m -76.63 33.2 0.13 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.9 t -49.09 -53.48 7.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 129.338 3.055 . . . . 0.0 113.847 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -71.86 -18.85 62.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.296 -1.502 . . . . 0.0 114.264 -177.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -61.59 -44.77 96.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 121.568 -0.707 . . . . 0.0 110.13 165.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.462 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m120 -71.5 -25.69 62.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.338 1.855 . . . . 0.0 112.389 -178.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -70.17 -33.77 72.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.569 -1.332 . . . . 0.0 110.525 174.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.51 -45.39 75.93 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.729 0.811 . . . . 0.0 112.027 169.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.462 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.1 mm -53.14 -48.5 53.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 C-N-CA 125.419 1.488 . . . . 0.0 113.374 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -57.4 -31.44 65.82 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.485 1.514 . . . . 0.0 114.267 178.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -70.48 -57.11 5.13 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.715 1.206 . . . . 0.0 111.948 173.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.5 t -60.4 -39.82 82.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.766 -1.209 . . . . 0.0 113.395 -177.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -56.45 -41.69 76.88 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 170.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.8 tttt -65.15 -37.16 86.5 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.148 -1.595 . . . . 0.0 113.345 177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.413 HG12 HD13 ' A' ' 72' ' ' LEU . 49.2 mt -65.31 -49.92 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 126.559 1.944 . . . . 0.0 110.855 173.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -37.87 82.48 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 124.656 1.182 . . . . 0.0 113.003 178.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.2 m -73.61 -40.92 63.47 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.739 1.616 . . . . 0.0 114.364 178.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -73.43 -40.46 64.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 118.957 -2.339 . . . . 0.0 114.282 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -84.34 47.88 1.41 Allowed 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.865 -1.147 . . . . 0.0 113.745 -178.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 82.9 mt -80.22 -35.85 35.62 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.775 -1.828 . . . . 0.0 110.67 168.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.5 -11.81 60.32 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.156 0.982 . . . . 0.0 112.708 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -135.22 70.69 68.62 Favored Pre-proline 0 N--CA 1.429 -1.498 0 O-C-N 120.395 -1.441 . . . . 0.0 110.496 176.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -73.88 -8.76 21.68 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 123.201 2.601 . . . . 0.0 112.587 -172.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.473 ' HG3' HD13 ' A' ' 27' ' ' ILE . 12.3 pt-20 -67.95 -23.86 65.11 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.422 1.489 . . . . 0.0 112.137 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.473 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -65.61 -42.26 92.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 O-C-N 120.683 -1.261 . . . . 0.0 109.78 176.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -64.56 -19.39 65.61 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.721 1.608 . . . . 0.0 112.866 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.7 mmt85 -79.53 -61.06 2.12 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.273 -1.517 . . . . 0.0 112.117 167.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.9 p -79.41 -24.58 42.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -165.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -53.4 -52.29 59.83 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.479 1.512 . . . . 0.0 113.207 172.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.17 -34.28 61.56 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.219 -1.551 . . . . 0.0 112.698 -174.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -50.93 -39.03 53.78 Favored 'General case' 0 N--CA 1.428 -1.538 0 N-CA-C 114.702 1.371 . . . . 0.0 114.702 172.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.567 HD13 ' HB3' ' A' ' 61' ' ' GLU . 49.6 mt -64.96 -50.73 73.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.898 1.679 . . . . 0.0 111.664 170.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.704 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.6 mt -67.18 -22.03 65.76 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.631 -2.543 . . . . 0.0 114.542 177.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -69.74 -30.33 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.184 -2.197 . . . . 0.0 112.963 172.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.32 -36.43 75.63 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.457 1.503 . . . . 0.0 111.148 168.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -73.73 -53.61 9.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.763 1.625 . . . . 0.0 114.523 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -17.19 64.09 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.212 1.931 . . . . 0.0 116.212 -174.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -46.59 -29.91 2.04 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 117.321 2.341 . . . . 0.0 117.321 177.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -45.55 -47.31 14.39 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 127.829 2.452 . . . . 0.0 115.035 167.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.65 18.54 10.75 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.605 1.962 . . . . 0.0 115.524 165.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.8 mt 70.67 35.67 1.79 Allowed 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 127.618 2.367 . . . . 0.0 113.078 -175.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.2 t-80 -68.53 -33.44 74.11 Favored 'General case' 0 CA--C 1.49 -1.365 0 C-N-CA 125.755 1.622 . . . . 0.0 112.381 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -138.31 169.29 18.05 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 121.497 -0.752 . . . . 0.0 109.55 164.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.3 tptt -116.2 129.53 56.35 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.624 1.569 . . . . 0.0 107.601 177.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 147.42 -81.05 0.21 Allowed Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.727 -1.233 . . . . 0.0 113.925 173.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -116.24 157.12 46.13 Favored Pre-proline 0 N--CA 1.429 -1.481 0 C-N-CA 125.105 1.362 . . . . 0.0 111.804 -171.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -76.37 116.31 4.3 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 C-N-CA 123.106 2.537 . . . . 0.0 112.442 168.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -99.95 -77.25 0.53 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.883 1.273 . . . . 0.0 108.038 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.02 -29.4 49.45 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 121.169 -0.957 . . . . 0.0 110.529 177.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.02 47.05 3.48 Favored Glycine 0 N--CA 1.431 -1.647 0 C-N-CA 125.696 1.617 . . . . 0.0 114.251 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.329 0.0 OUTLIER 20.66 -132.02 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.468 1 C-N-CA 132.516 4.326 . . . . 0.0 118.781 165.763 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 98.2 p -97.6 137.06 37.1 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.633 1.206 . . . . 0.0 110.132 163.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.422 ' HB2' HD22 ' A' ' 80' ' ' LEU . 12.4 pt-20 -63.31 -25.34 68.26 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.092 -1.63 . . . . 0.0 111.68 170.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -63.07 -30.47 71.62 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.231 2.212 . . . . 0.0 113.61 174.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -83.77 -38.82 20.82 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 120.752 1.615 . . . . 0.0 108.313 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 62' ' ' VAL 0.251 0.4 OUTLIER -63.97 -39.95 87.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 122.448 1.118 . . . . 0.0 109.869 -177.191 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 24.3 t80 -54.0 -57.68 10.12 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.251 2.22 . . . . 0.0 115.475 160.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.63 -39.63 61.94 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.084 1.754 . . . . 0.0 114.989 178.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.567 ' HB3' HD13 ' A' ' 34' ' ' ILE . 79.6 mm-40 -68.94 -56.13 8.82 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.286 1.434 . . . . 0.0 110.602 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.65 ' HA ' HD23 ' A' ' 65' ' ' LEU . 83.6 t -50.16 -32.08 8.51 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.824 2.05 . . . . 0.0 115.822 178.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.11 -39.97 92.02 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.579 -1.325 . . . . 0.0 112.731 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -74.44 -28.17 60.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.282 -0.886 . . . . 0.0 113.204 -174.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.65 HD23 ' HA ' ' A' ' 62' ' ' VAL . 2.6 mm? -57.82 -45.08 86.65 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.776 1.631 . . . . 0.0 112.755 173.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -98.3 -37.81 9.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.806 1.642 . . . . 0.0 110.238 -159.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.274 45.5 ptt85 25.91 95.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 120.83 3.641 . . . . 0.0 120.83 171.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 119.34 -27.07 7.12 Favored Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -90.1 98.82 11.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 122.224 1.011 . . . . 0.0 110.777 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -81.4 -25.52 36.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.77 1.628 . . . . 0.0 113.596 -178.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 40.2 p-10 -71.0 -35.65 72.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.487 -1.383 . . . . 0.0 112.605 -174.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.413 HD13 HG12 ' A' ' 17' ' ' ILE . 73.2 mt -63.98 -41.29 97.57 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.118 -1.614 . . . . 0.0 113.882 172.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -73.55 -23.02 59.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.058 -2.276 . . . . 0.0 113.61 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 71.2 m -67.3 -44.8 78.34 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.609 1.163 . . . . 0.0 111.153 174.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -77.88 -17.97 56.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.076 1.35 . . . . 0.0 114.146 174.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -63.92 -20.03 65.55 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.587 1.555 . . . . 0.0 113.103 168.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.48 -15.8 64.33 Favored Glycine 0 N--CA 1.43 -1.735 0 C-N-CA 130.42 3.867 . . . . 0.0 116.14 173.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -42.24 -45.12 4.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.474 2.71 . . . . 0.0 115.115 -174.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -97.1 -52.19 3.94 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.0 0.92 . . . . 0.0 109.819 168.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.386 18.0 mt -42.35 -82.14 0.01 OUTLIER Pre-proline 0 N--CA 1.429 -1.477 0 N-CA-C 120.283 3.438 . . . . 0.0 120.283 -149.678 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -73.23 101.61 1.37 Allowed 'Trans proline' 0 N--CA 1.433 -2.035 0 CA-C-N 126.992 3.533 . . . . 0.0 113.675 -176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -68.72 -57.03 6.23 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.836 1.655 . . . . 0.0 112.532 -179.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -165.09 91.5 0.54 Allowed 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 103.726 -2.694 . . . . 0.0 103.726 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -100.71 -58.58 1.87 Allowed 'General case' 0 N--CA 1.428 -1.53 0 O-C-N 121.302 -0.874 . . . . 0.0 112.592 -163.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.0 mtm105 . . . . . 0 C--O 1.26 1.631 0 C-N-CA 124.577 1.151 . . . . 0.0 111.572 177.785 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.8 m . . . . . 0 CA--C 1.489 -1.369 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 52.0 mtm-85 72.42 156.49 0.17 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.707 1.603 . . . . 0.0 112.955 -170.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.0 mtt -77.04 166.13 23.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.17 -1.582 . . . . 0.0 112.854 -178.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -173.71 -178.71 1.65 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 103.168 -2.901 . . . . 0.0 103.168 172.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 1.3 mt -76.14 -22.74 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 O-C-N 120.272 -1.518 . . . . 0.0 110.552 166.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -52.25 -33.2 40.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 116.804 2.15 . . . . 0.0 116.804 177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 26.5 mtt -56.18 -30.55 62.4 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.742 1.617 . . . . 0.0 115.012 171.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 99.0 mt -70.68 -27.79 64.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.996 -1.69 . . . . 0.0 115.519 -170.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.704 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -79.34 -28.17 42.07 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.258 1.423 . . . . 0.0 109.957 177.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.64 -45.35 15.9 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.356 1.062 . . . . 0.0 110.767 -177.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -62.56 -37.63 86.91 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 113.318 175.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.15 -45.02 93.85 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -64.26 -47.52 79.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.884 1.673 . . . . 0.0 111.989 179.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -53.12 -50.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.274 2.63 . . . . 0.0 113.944 172.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.43 -25.45 63.21 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.816 -1.802 . . . . 0.0 115.114 -178.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -71.89 -25.73 62.04 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.471 1.108 . . . . 0.0 113.815 170.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -74.77 -36.97 62.56 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.633 -1.292 . . . . 0.0 112.547 169.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 -57.13 -25.6 59.12 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 115.289 1.589 . . . . 0.0 115.289 173.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -64.36 -36.15 83.21 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.56 1.144 . . . . 0.0 113.617 171.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -73.26 -50.52 21.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.072 -1.642 . . . . 0.0 110.273 176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -63.86 -20.12 65.57 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 127.584 2.354 . . . . 0.0 115.99 -176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.07 -19.51 5.0 Favored 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 127.818 2.447 . . . . 0.0 115.894 170.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -59.86 -35.09 74.06 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.422 1.638 . . . . 0.0 115.422 172.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.2 p80 . . . . . 0 C--O 1.26 1.625 0 C-N-CA 124.153 0.981 . . . . 0.0 111.99 -178.855 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 CA--C 1.49 -1.335 0 CA-C-O 120.568 0.223 . . . . 0.0 111.516 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 90.0 p -140.63 144.18 35.61 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.429 -1.419 . . . . 0.0 108.797 160.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -120.04 -69.09 0.86 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.451 1.1 . . . . 0.0 108.088 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 73.1 m 68.01 35.57 3.67 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.2 1.926 . . . . 0.0 116.2 166.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.4 -44.41 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.347 1.859 . . . . 0.0 111.463 175.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -65.46 -26.68 68.05 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.04 1.336 . . . . 0.0 114.394 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -70.83 -34.79 72.05 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 123.92 0.888 . . . . 0.0 109.892 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 40.6 m-80 -80.34 -24.77 39.65 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.281 1.433 . . . . 0.0 111.219 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -68.05 -35.4 78.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.857 -1.152 . . . . 0.0 111.032 164.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.53 -43.53 89.71 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.655 -1.278 . . . . 0.0 111.585 172.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -56.9 -55.82 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 125.442 1.497 . . . . 0.0 113.384 172.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 t -59.84 -32.16 70.42 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.921 1.289 . . . . 0.0 114.402 -172.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.474 ' CZ ' HD11 ' A' ' 17' ' ' ILE . 59.8 t80 -59.9 -59.06 6.04 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.746 1.619 . . . . 0.0 112.179 170.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.7 t -61.15 -40.22 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.375 1.47 . . . . 0.0 111.976 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -56.21 -48.27 76.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 169.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.4 ttmt -59.5 -39.2 83.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.448 -2.032 . . . . 0.0 113.439 176.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.474 HD11 ' CZ ' ' A' ' 13' ' ' TYR . 96.2 mt -63.11 -51.65 68.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 126.278 1.831 . . . . 0.0 111.649 173.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 pttp -59.44 -38.09 79.8 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 121.054 -1.028 . . . . 0.0 112.799 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -75.68 -37.52 59.47 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.333 1.053 . . . . 0.0 113.762 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 14.5 mmt-85 -74.98 -42.22 58.0 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.554 -2.591 . . . . 0.0 114.074 174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -89.78 44.21 1.19 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.096 -1.628 . . . . 0.0 113.867 -174.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 68.7 mt -77.7 -31.65 52.5 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.359 1.464 . . . . 0.0 110.375 169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 -81.14 -3.82 53.33 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.584 -0.698 . . . . 0.0 112.655 171.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -142.66 73.59 19.68 Favored Pre-proline 0 N--CA 1.43 -1.441 0 O-C-N 120.22 -1.55 . . . . 0.0 112.252 173.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -68.77 -12.03 33.46 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 122.708 2.272 . . . . 0.0 115.782 -173.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -67.9 -19.63 65.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.782 -1.199 . . . . 0.0 113.06 171.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.2 OUTLIER -74.4 -44.93 47.62 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 C-N-CA 126.285 1.834 . . . . 0.0 108.38 179.647 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -59.47 -50.39 74.1 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.482 1.113 . . . . 0.0 112.026 176.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -56.45 -49.34 74.9 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 79.1 p -80.02 -29.94 39.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.516 1.672 . . . . 0.0 115.516 -172.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.279 0.0 OUTLIER -64.47 -39.34 93.62 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.083 -1.636 . . . . 0.0 114.192 177.842 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -70.83 -36.6 72.99 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.611 -1.306 . . . . 0.0 111.676 176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -47.32 -43.26 22.61 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 167.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 57.9 mt -70.12 -42.38 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 127.225 2.21 . . . . 0.0 112.683 170.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.2 OUTLIER -62.25 -31.43 71.99 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 117.493 -3.255 . . . . 0.0 114.028 172.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 89.7 m-70 -65.28 -39.03 92.04 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 120.096 -1.628 . . . . 0.0 112.299 172.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.8 m -48.52 -41.57 30.55 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 121.206 1.821 . . . . 0.0 113.445 171.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -68.04 -63.31 1.09 Allowed 'General case' 0 N--CA 1.43 -1.426 0 CA-C-O 122.29 1.043 . . . . 0.0 112.88 169.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.35 -19.64 49.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.8 1.407 . . . . 0.0 114.8 -158.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 25.2 tttm -59.04 -36.42 74.97 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 128.698 2.799 . . . . 0.0 115.998 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -79.61 -32.77 41.87 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.125 0.964 . . . . 0.0 111.879 176.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -86.54 -51.82 5.94 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.886 1.274 . . . . 0.0 113.724 -168.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.26 74.2 mt 53.23 -139.69 1.0 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 127.28 2.232 . . . . 0.0 116.222 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -135.63 52.83 1.99 Allowed 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.124 -1.61 . . . . 0.0 110.246 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.4 t -92.5 158.41 16.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.538 -1.351 . . . . 0.0 110.847 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -110.66 120.51 42.66 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.7 -1.25 . . . . 0.0 111.108 -172.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.21 -107.57 0.33 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.079 -1.013 . . . . 0.0 113.427 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.9 ptm85 -72.02 159.3 85.83 Favored Pre-proline 0 N--CA 1.429 -1.497 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -168.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.07 109.12 2.81 Favored 'Trans proline' 0 C--N 1.3 -2.02 0 C-N-CA 122.502 2.135 . . . . 0.0 112.396 167.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -107.01 154.47 21.07 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 176.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.3 ptt-85 -154.12 109.97 3.23 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.799 1.285 . . . . 0.0 108.148 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.24 117.28 8.31 Favored Glycine 0 N--CA 1.432 -1.615 0 O-C-N 120.746 -1.221 . . . . 0.0 113.35 172.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.288 24.6 ptt? 44.73 -134.51 0.68 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.862 2.465 . . . . 0.0 117.354 162.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.6 t -116.06 135.96 53.46 Favored 'General case' 0 N--CA 1.431 -1.384 0 CA-C-O 123.205 1.479 . . . . 0.0 109.833 158.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -69.01 -18.17 64.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.508 2.323 . . . . 0.0 112.187 179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -77.2 -17.17 58.71 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.175 -1.578 . . . . 0.0 114.832 169.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -82.22 -36.58 27.07 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.905 -2.372 . . . . 0.0 108.632 -175.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.252 0.5 OUTLIER -62.43 -41.47 91.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.041 1.4 . . . . 0.0 109.736 179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.7 t80 -54.83 -55.1 33.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 113.0 165.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -38.5 65.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.074 1.75 . . . . 0.0 114.757 -178.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.34 18.2 mt-10 -75.78 -43.04 48.46 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.679 -1.263 . . . . 0.0 114.206 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.513 ' HA ' HD13 ' A' ' 65' ' ' LEU . 74.4 t -58.65 -28.23 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 120.548 1.522 . . . . 0.0 114.362 173.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.51 -31.17 71.16 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.188 1.795 . . . . 0.0 113.187 -177.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -75.66 -36.61 60.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 121.949 0.88 . . . . 0.0 111.928 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -62.87 -40.28 97.04 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.1 1.76 . . . . 0.0 111.895 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -104.95 24.86 11.26 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.335 1.454 . . . . 0.0 108.508 -166.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -68.56 126.91 31.17 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.801 -1.812 . . . . 0.0 115.276 -165.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.48 -39.62 2.84 Favored Glycine 0 N--CA 1.431 -1.672 0 O-C-N 120.727 -1.233 . . . . 0.0 111.977 -174.111 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -101.72 95.87 6.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 124.533 2.111 . . . . 0.0 110.916 -176.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -80.41 -17.6 51.34 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -168.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -61.32 -36.88 81.35 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 124.85 1.26 . . . . 0.0 113.479 -172.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.0 -40.03 83.62 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.115 1.766 . . . . 0.0 113.793 173.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -81.33 -25.57 36.3 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 119.939 -1.725 . . . . 0.0 111.884 178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 21.5 t -67.4 -54.47 20.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.738 1.615 . . . . 0.0 111.356 177.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 82.1 mt-10 -69.45 -18.27 63.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.874 1.669 . . . . 0.0 113.326 177.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -29.63 70.87 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.858 -1.151 . . . . 0.0 113.32 168.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.81 -18.35 56.58 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 128.243 2.83 . . . . 0.0 115.643 -177.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -66.86 -19.68 65.78 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 178.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -95.48 -46.02 6.85 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 121.036 -1.04 . . . . 0.0 110.739 162.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.472 HD21 HD12 ' B' ' 202' ' ' ILE . 93.4 mt -82.86 162.34 55.42 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 114.678 1.362 . . . . 0.0 114.678 -158.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -74.99 136.4 20.37 Favored 'Trans proline' 0 C--N 1.3 -2.016 0 CA-C-N 122.617 1.97 . . . . 0.0 113.407 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -125.51 83.51 2.17 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.13 1.443 . . . . 0.0 109.532 -174.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -141.39 46.11 1.72 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.42 1.488 . . . . 0.0 107.14 -173.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.2 ttmm -90.13 -45.36 9.18 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.829 -1.078 . . . . 0.0 111.091 -161.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? . . . . . 0 C--O 1.26 1.622 0 C-N-CA 124.242 1.017 . . . . 0.0 111.859 177.298 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 25.2 m . . . . . 0 CA--C 1.49 -1.363 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 17.9 ptt180 -161.64 -177.4 5.88 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.283 -0.885 . . . . 0.0 110.676 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.1 ptp -77.22 66.46 3.01 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.27 -1.519 . . . . 0.0 114.75 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.04 145.4 55.96 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.644 -1.91 . . . . 0.0 111.007 173.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 80' ' ' LEU 0.371 14.1 mt -62.32 -19.21 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 O-C-N 120.076 -1.64 . . . . 0.0 115.159 -170.195 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -43.87 -35.07 1.81 Allowed 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 117.926 2.565 . . . . 0.0 117.926 165.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.9 mtp -61.28 -25.12 66.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 116.318 1.97 . . . . 0.0 116.318 173.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 76.3 mt -70.88 -37.12 73.03 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 117.038 2.236 . . . . 0.0 117.038 -171.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.57 -20.81 61.25 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.634 1.174 . . . . 0.0 110.533 179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -81.05 -47.72 13.19 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.697 1.199 . . . . 0.0 111.262 171.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.04 -40.88 77.61 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.229 1.812 . . . . 0.0 114.709 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.84 83.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 124.694 1.197 . . . . 0.0 113.71 173.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -69.5 -36.67 76.7 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.631 1.172 . . . . 0.0 113.107 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -56.33 -49.73 73.5 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.634 1.974 . . . . 0.0 112.147 167.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 9.7 mt -68.69 -37.11 79.31 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -61.63 -38.95 89.56 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.774 -1.204 . . . . 0.0 112.892 170.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.68 -39.47 88.55 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.622 -1.299 . . . . 0.0 113.352 171.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . 0.442 ' HB3' HH11 ' B' ' 215' ' ' ARG . 0.2 OUTLIER -64.45 -25.23 67.92 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 174.366 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.23 -40.07 64.98 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.352 -1.467 . . . . 0.0 111.812 171.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -63.71 -47.46 81.04 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.695 1.198 . . . . 0.0 113.514 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -53.92 -42.77 69.14 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 127.311 2.245 . . . . 0.0 116.484 -177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.58 -19.67 58.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.969 1.84 . . . . 0.0 115.969 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.29 -17.62 56.36 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 114.986 1.476 . . . . 0.0 114.986 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 20.7 m170 . . . . . 0 C--O 1.26 1.633 0 N-CA-C 114.985 1.476 . . . . 0.0 114.985 -178.115 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.9 mp0 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.0 m 75.74 177.36 0.2 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.133 1.773 . . . . 0.0 112.955 174.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -117.53 129.67 55.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 121.075 -1.016 . . . . 0.0 111.974 -176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.3 m 68.04 37.56 2.96 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.098 2.629 . . . . 0.0 118.098 152.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.9 t -50.41 -60.57 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 127.869 2.468 . . . . 0.0 115.99 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -80.95 -20.36 42.14 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 120.37 -1.456 . . . . 0.0 112.47 -172.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.81 -43.3 98.37 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.343 163.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 93.7 m-20 -71.63 -20.51 61.96 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.556 1.543 . . . . 0.0 112.775 -178.494 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -80.12 -25.76 39.78 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.933 -1.73 . . . . 0.0 111.761 171.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -70.0 -45.56 67.0 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.157 -0.965 . . . . 0.0 111.546 164.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -51.32 -52.84 17.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.49 0 C-N-CA 126.379 1.871 . . . . 0.0 113.441 174.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.5 m -59.56 -25.42 64.54 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -69.01 -54.96 12.4 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 121.198 -0.939 . . . . 0.0 111.919 171.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.0 t -57.02 -40.79 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 125.936 1.695 . . . . 0.0 112.507 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.72 -46.81 86.39 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 169.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -42.81 76.24 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.323 -2.111 . . . . 0.0 113.861 175.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 83.7 mt -60.48 -50.14 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.174 1.79 . . . . 0.0 111.257 173.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 5.3 pttt -61.56 -40.21 93.92 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.703 -1.248 . . . . 0.0 113.618 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -69.44 -32.37 71.28 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.321 1.848 . . . . 0.0 112.781 -178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.7 -54.85 7.85 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.986 -2.321 . . . . 0.0 112.773 169.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.6 m-85 -82.07 44.28 0.84 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -174.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.24 -31.59 60.87 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.746 -1.846 . . . . 0.0 110.108 168.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -70.12 -23.73 63.07 Favored 'General case' 0 N--CA 1.431 -1.406 0 CA-C-O 121.688 0.756 . . . . 0.0 112.703 170.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -129.57 64.8 72.93 Favored Pre-proline 0 N--CA 1.43 -1.45 0 O-C-N 120.303 -1.498 . . . . 0.0 110.098 -175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.73 0.7 8.9 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 CA-C-N 124.614 2.684 . . . . 0.0 113.344 -167.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -76.9 -21.71 54.49 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.275 1.43 . . . . 0.0 112.742 172.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.433 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.4 mm -63.08 -37.38 79.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 125.053 1.341 . . . . 0.0 109.795 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -55.06 -28.78 54.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.253 2.221 . . . . 0.0 114.207 175.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -79.52 -58.09 3.37 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.194 -1.566 . . . . 0.0 110.847 170.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 30.6 t -71.34 -31.76 67.76 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.001 1.321 . . . . 0.0 114.172 -160.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.294 0.2 OUTLIER -66.7 -36.75 83.24 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.12 -1.612 . . . . 0.0 114.455 175.656 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.78 -38.62 73.41 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.178 -1.576 . . . . 0.0 112.243 178.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -49.89 -39.95 41.34 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 170.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.0 mt -65.85 -43.76 93.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.165 -1.584 . . . . 0.0 112.403 170.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.2 mt -66.18 -19.4 65.82 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.629 -2.544 . . . . 0.0 114.941 174.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 14.8 m170 -66.73 -33.08 74.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.157 -2.215 . . . . 0.0 113.595 172.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 19.1 m -59.46 -30.98 68.9 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.089 1.756 . . . . 0.0 111.779 172.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -75.3 -60.94 2.08 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.954 1.302 . . . . 0.0 113.759 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.66 -16.02 63.28 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 116.04 1.867 . . . . 0.0 116.04 -169.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -40.38 -33.11 0.23 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 129.495 3.118 . . . . 0.0 118.712 174.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -58.82 -19.46 41.59 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.176 1.917 . . . . 0.0 116.176 171.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 62.9 mt-30 -118.34 -55.67 2.21 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.74 1.616 . . . . 0.0 112.652 176.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.2 mt 63.68 -75.42 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 127.097 2.159 . . . . 0.0 116.154 -174.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -146.52 12.65 1.18 Allowed 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.72 1.208 . . . . 0.0 109.24 175.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -130.58 -168.35 1.97 Allowed 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.853 -1.779 . . . . 0.0 109.711 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.8 mttt -76.62 163.68 26.63 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.126 1.371 . . . . 0.0 112.171 -175.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -80.16 101.99 2.01 Favored Glycine 0 N--CA 1.43 -1.753 0 O-C-N 120.427 -1.421 . . . . 0.0 113.479 -171.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -75.02 155.46 86.48 Favored Pre-proline 0 N--CA 1.429 -1.488 0 C-N-CA 124.228 1.011 . . . . 0.0 110.979 175.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -70.44 79.67 1.14 Allowed 'Trans proline' 0 N--CA 1.434 -1.977 0 C-N-CA 122.167 1.911 . . . . 0.0 113.417 160.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -93.05 -132.31 0.14 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.566 1.946 . . . . 0.0 109.421 178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.04 -109.7 0.31 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.157 -1.589 . . . . 0.0 108.6 166.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.63 124.91 2.36 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.197 -1.564 . . . . 0.0 109.619 -168.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.44 ' HG3' ' H ' ' A' ' 53' ' ' MET . 0.0 OUTLIER -73.36 -156.15 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 126.911 2.084 . . . . 0.0 113.435 -178.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.422 ' H ' ' HB2' ' A' ' 53' ' ' MET . 61.9 m -106.23 148.76 27.55 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.906 -1.121 . . . . 0.0 109.84 -177.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -52.11 -37.82 55.42 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 127.937 2.495 . . . . 0.0 113.849 -175.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -54.04 -29.42 43.8 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 173.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -84.44 -40.15 18.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-N 122.117 2.235 . . . . 0.0 110.318 -175.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.76 -37.19 77.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 CA-C-O 123.288 1.518 . . . . 0.0 110.464 -175.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -56.22 -49.83 72.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 127.952 2.501 . . . . 0.0 114.013 162.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -47.09 79.21 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.243 1.417 . . . . 0.0 113.749 176.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.479 ' O ' HD12 ' A' ' 65' ' ' LEU 0.354 19.8 mt-10 -74.41 -38.07 63.19 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.374 -1.454 . . . . 0.0 112.327 -175.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.3 -35.37 42.76 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 CA-C-N 120.69 1.586 . . . . 0.0 114.609 170.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.41 72.03 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.806 1.242 . . . . 0.0 112.136 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -70.58 -33.91 71.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 121.23 -0.919 . . . . 0.0 111.906 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.9 mp -68.82 -31.41 70.37 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.653 1.216 . . . . 0.0 113.002 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -101.08 -4.84 26.61 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 124.81 1.244 . . . . 0.0 110.797 -166.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -38.13 121.9 1.0 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 128.929 2.892 . . . . 0.0 117.306 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.82 -36.82 4.15 Favored Glycine 0 N--CA 1.43 -1.705 0 C-N-CA 124.832 1.206 . . . . 0.0 111.797 -169.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -95.3 94.31 7.79 Favored 'General case' 0 N--CA 1.431 -1.395 0 CA-C-O 123.329 1.538 . . . . 0.0 110.386 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -80.98 -25.1 37.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.724 -1.235 . . . . 0.0 113.954 -174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -69.59 -25.72 64.11 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 120.825 -1.172 . . . . 0.0 113.906 -173.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.8 mt -68.54 -39.18 81.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.911 -1.118 . . . . 0.0 113.658 173.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.36 -20.25 59.11 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.272 -2.143 . . . . 0.0 111.441 178.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.4 t -68.02 -43.7 78.18 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.581 1.553 . . . . 0.0 112.677 172.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -68.28 -20.08 64.75 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.098 1.359 . . . . 0.0 113.697 168.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.15 -22.69 59.33 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.175 -1.578 . . . . 0.0 111.414 171.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.74 -16.23 69.8 Favored Glycine 0 N--CA 1.43 -1.756 0 C-N-CA 126.481 1.991 . . . . 0.0 115.624 -176.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -55.08 -45.88 75.43 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.5 1.52 . . . . 0.0 113.215 177.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -85.84 -50.91 6.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.654 1.182 . . . . 0.0 111.153 167.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.0 mt -76.28 158.99 81.04 Favored Pre-proline 0 N--CA 1.429 -1.502 0 N-CA-C 116.131 1.9 . . . . 0.0 116.131 -158.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -69.01 152.78 73.16 Favored 'Trans proline' 0 C--N 1.3 -2.026 0 C-N-CA 122.44 2.093 . . . . 0.0 112.919 169.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -78.5 -52.85 7.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 121.965 0.888 . . . . 0.0 109.67 165.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.1 -78.82 0.11 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 175.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.0 ptpt -150.14 63.33 0.97 Allowed 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.487 1.613 . . . . 0.0 109.667 167.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 . . . . . 0 C--O 1.26 1.656 0 C-N-CA 126.155 1.782 . . . . 0.0 111.097 167.788 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 CA--C 1.491 -1.321 0 CA-C-O 123.581 1.657 . . . . 0.0 111.699 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 33.9 mmt180 -114.27 62.8 0.66 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.152 -2.218 . . . . 0.0 109.395 -178.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.96 65.7 6.2 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.661 1.584 . . . . 0.0 109.944 166.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -72.29 162.45 29.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 122.109 0.957 . . . . 0.0 111.771 -172.355 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.414 HG23 HD13 ' A' ' 35' ' ' LEU 0.255 36.8 mt -61.15 -29.3 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 O-C-N 120.724 -1.235 . . . . 0.0 112.065 173.853 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 39.9 tt0 -43.08 -46.88 5.86 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.482 2.03 . . . . 0.0 116.482 163.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.3 ttp -81.06 -21.7 39.86 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.064 1.745 . . . . 0.0 113.625 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 15.5 mt -61.81 -35.74 79.11 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 -176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -76.08 -16.67 59.87 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.778 1.231 . . . . 0.0 112.668 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -81.71 -47.83 12.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.519 -0.738 . . . . 0.0 110.566 172.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.51 -34.62 67.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.556 1.543 . . . . 0.0 114.46 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.36 -43.46 90.75 Favored 'General case' 0 N--CA 1.429 -1.518 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 175.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -69.34 -44.24 72.05 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.884 1.274 . . . . 0.0 110.902 177.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -51.01 -47.94 61.53 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.544 2.338 . . . . 0.0 113.704 173.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.26 -25.73 63.49 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.939 -1.726 . . . . 0.0 115.284 179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -68.65 -29.0 67.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.204 -1.56 . . . . 0.0 113.04 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 91.6 mtt-85 -74.08 -29.52 61.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.555 -1.341 . . . . 0.0 112.252 171.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 79.7 mtt180 -65.64 -39.47 91.45 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.743 -1.223 . . . . 0.0 113.275 167.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -60.02 -52.08 66.9 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.469 -1.394 . . . . 0.0 112.558 175.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.6 mmt180 -60.6 -38.17 83.82 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -69.01 -49.12 60.57 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.589 1.555 . . . . 0.0 113.597 175.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.02 -30.21 69.4 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.969 1.308 . . . . 0.0 113.661 -177.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -57.39 -52.33 65.8 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 121.149 -0.969 . . . . 0.0 113.388 171.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 . . . . . 0 C--O 1.26 1.607 0 C-N-CA 126.471 1.908 . . . . 0.0 115.504 169.791 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 120.97 0.414 . . . . 0.0 111.468 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.271 1.0 OUTLIER 77.49 -173.25 0.08 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.212 2.205 . . . . 0.0 111.302 177.743 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.33 -82.98 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.262 -1.524 . . . . 0.0 113.821 -177.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.26 4.1 m 75.11 88.22 0.09 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.421 2.288 . . . . 0.0 109.686 -165.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 70.9 t -73.33 -49.14 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 126.441 1.896 . . . . 0.0 108.04 -177.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -66.25 -24.7 66.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.086 0.954 . . . . 0.0 113.308 -178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -59.21 -48.63 80.9 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 123.407 0.683 . . . . 0.0 110.799 169.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.4 t-20 -76.26 -23.22 54.46 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.112 1.765 . . . . 0.0 109.416 -171.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -79.33 -32.21 43.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.499 -1.376 . . . . 0.0 109.946 176.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.37 -41.83 75.99 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.495 1.118 . . . . 0.0 111.461 170.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.4 mm -53.46 -50.27 49.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 125.277 1.431 . . . . 0.0 111.946 172.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.5 p -55.98 -27.3 52.14 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' CE2' HD11 ' A' ' 17' ' ' ILE . 35.3 t80 -74.81 -56.83 4.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.91 -1.119 . . . . 0.0 111.277 176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.425 HG23 ' H ' ' A' ' 14' ' ' VAL . 1.8 t -61.17 -33.44 56.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 124.732 1.213 . . . . 0.0 112.338 178.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -62.73 -44.7 95.54 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 115.263 1.579 . . . . 0.0 115.263 168.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.4 mtmm -64.68 -34.68 78.86 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.608 -1.933 . . . . 0.0 113.149 174.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.426 HD11 ' CE2' ' A' ' 13' ' ' TYR . 46.2 mt -60.2 -53.41 49.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.908 1.683 . . . . 0.0 110.67 171.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.08 -36.15 76.75 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -77.25 -21.09 54.26 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.294 1.838 . . . . 0.0 114.028 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.1 mtp180 -97.13 -35.47 10.78 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 118.845 -2.409 . . . . 0.0 112.515 173.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 39.6 m-85 -89.11 42.07 1.07 Allowed 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.193 -1.567 . . . . 0.0 111.919 177.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.41 -43.62 85.26 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.493 1.917 . . . . 0.0 112.579 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -87.7 2.7 50.4 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 114.49 -1.232 . . . . 0.0 110.715 177.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 23.2 m170 -128.54 66.59 74.58 Favored Pre-proline 0 N--CA 1.43 -1.465 0 O-C-N 120.504 -1.372 . . . . 0.0 110.382 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -76.71 -1.14 11.23 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 124.029 3.153 . . . . 0.0 114.295 -167.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.81 -18.53 50.69 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.264 1.026 . . . . 0.0 112.398 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -66.87 -39.62 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 119.958 -1.714 . . . . 0.0 110.287 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -52.48 -42.56 64.36 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.463 1.505 . . . . 0.0 113.714 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 25.1 mmt85 -69.33 -52.57 26.06 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.897 -1.127 . . . . 0.0 112.662 172.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.2 t -76.54 -32.82 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -163.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.316 0.1 OUTLIER -65.71 -37.17 85.68 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.218 -2.176 . . . . 0.0 113.841 177.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.62 -37.53 70.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.303 -1.498 . . . . 0.0 112.877 175.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.04 -41.57 26.09 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.912 1.285 . . . . 0.0 113.965 172.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.473 HD13 ' HB3' ' A' ' 61' ' ' GLU . 47.6 mt -66.11 -48.73 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 C-N-CA 125.854 1.662 . . . . 0.0 111.232 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.667 HD13 HG23 ' B' ' 202' ' ' ILE . 2.3 mt -61.32 -34.88 75.98 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.733 -1.854 . . . . 0.0 114.773 178.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -53.51 -42.65 67.59 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.679 1.591 . . . . 0.0 114.081 173.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.14 -30.8 71.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.726 2.01 . . . . 0.0 112.781 179.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -75.79 -61.11 2.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.184 -0.947 . . . . 0.0 112.079 166.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.83 -17.21 62.9 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 116.322 1.971 . . . . 0.0 116.322 -162.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -51.77 -35.68 44.66 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 126.833 2.053 . . . . 0.0 115.451 173.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -62.54 -41.02 98.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.429 -1.419 . . . . 0.0 114.177 177.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 57.25 34.27 24.53 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.083 2.153 . . . . 0.0 115.496 164.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 42.8 mt 66.02 13.96 9.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.246 2.618 . . . . 0.0 115.565 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 -91.28 61.68 4.52 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.02 -1.675 . . . . 0.0 111.383 -178.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.8 m -80.4 96.71 6.79 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.703 -1.248 . . . . 0.0 112.692 -174.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -95.0 -44.84 7.51 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 125.025 1.33 . . . . 0.0 110.944 -178.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -133.43 -115.56 1.62 Allowed Glycine 0 N--CA 1.43 -1.718 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.3 ptt180 -100.27 161.0 25.54 Favored Pre-proline 0 N--CA 1.429 -1.513 0 O-C-N 121.696 -0.885 . . . . 0.0 111.17 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -72.66 157.64 51.94 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.251 1.967 . . . . 0.0 113.88 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -122.84 -86.03 0.65 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.92 1.288 . . . . 0.0 109.107 178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.33 -55.88 3.93 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.712 -1.243 . . . . 0.0 110.992 -179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.47 107.57 2.19 Favored Glycine 0 N--CA 1.429 -1.768 0 CA-C-O 121.93 0.739 . . . . 0.0 114.325 -175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -92.28 -123.97 0.08 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.487 2.315 . . . . 0.0 114.011 -172.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -110.1 158.61 18.13 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.841 1.656 . . . . 0.0 110.383 178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.435 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.488 -1.407 0 C-N-CA 125.743 1.617 . . . . 0.0 112.203 172.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -55.42 -43.99 75.84 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.8 2.148 . . . . 0.0 116.8 175.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.59 -32.54 23.71 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 120.692 1.587 . . . . 0.0 109.789 -172.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.266 0.3 OUTLIER -61.69 -44.65 99.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 122.623 1.201 . . . . 0.0 108.931 179.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -58.8 -52.68 64.68 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.096 2.158 . . . . 0.0 113.55 167.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.84 -41.84 62.12 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.708 1.603 . . . . 0.0 114.695 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.473 ' HB3' HD13 ' A' ' 34' ' ' ILE . 32.3 mm-40 -70.29 -47.93 58.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.362 1.065 . . . . 0.0 112.473 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.484 ' HA ' HD13 ' A' ' 65' ' ' LEU . 75.2 t -57.2 -34.49 45.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 CA-C-O 123.413 1.578 . . . . 0.0 114.488 176.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.23 -26.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.125 1.77 . . . . 0.0 112.598 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 73.4 m-20 -69.62 -44.92 69.69 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 121.825 0.822 . . . . 0.0 111.013 177.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.485 HD12 ' H ' ' A' ' 65' ' ' LEU . 4.9 mp -64.98 -28.79 69.75 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-O 122.905 1.336 . . . . 0.0 112.262 -173.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -102.78 -9.33 20.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.647 1.179 . . . . 0.0 110.889 -168.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.9 ttm-85 -47.04 123.62 5.51 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.114 2.565 . . . . 0.0 117.059 -168.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 110.77 -31.47 7.28 Favored Glycine 0 N--CA 1.431 -1.7 0 C-N-CA 125.162 1.363 . . . . 0.0 110.207 -171.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -95.91 106.85 19.04 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.921 1.343 . . . . 0.0 109.574 172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -80.26 -27.49 38.6 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 126.049 1.739 . . . . 0.0 111.948 178.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -56.6 -38.23 71.76 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 128.45 2.7 . . . . 0.0 113.586 -174.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.89 -40.6 60.83 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 177.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.66 -19.35 59.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 118.911 -2.368 . . . . 0.0 113.094 -175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.2 t -59.39 -52.77 64.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.375 1.47 . . . . 0.0 111.606 168.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -69.54 -19.91 63.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.61 1.564 . . . . 0.0 113.558 175.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -71.76 -20.03 61.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.526 -1.359 . . . . 0.0 112.5 172.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -78.86 -17.97 76.1 Favored Glycine 0 N--CA 1.431 -1.668 0 C-N-CA 127.623 2.535 . . . . 0.0 115.393 -176.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -53.24 -46.68 69.27 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 119.874 1.837 . . . . 0.0 115.106 -169.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -99.75 -26.26 14.1 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.128 178.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.333 18.1 mt -64.77 -82.64 0.03 OUTLIER Pre-proline 0 N--CA 1.43 -1.471 0 N-CA-C 117.939 2.57 . . . . 0.0 117.939 -169.197 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -73.28 163.8 36.94 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 CA-C-N 127.405 3.68 . . . . 0.0 112.393 177.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -99.44 0.07 Allowed 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.525 1.13 . . . . 0.0 113.717 -165.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -111.66 -35.66 5.7 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.218 -1.551 . . . . 0.0 108.207 -173.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 16.5 mtmt 63.1 61.41 1.1 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.897 2.479 . . . . 0.0 111.607 -172.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.317 2.5 mpt_? . . . . . 0 C--O 1.26 1.652 0 C-N-CA 128.889 2.876 . . . . 0.0 112.412 -165.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 CA--C 1.491 -1.309 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.262 2.5 ttt85 67.34 137.82 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 0.0 114.654 -175.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 28.1 ptm -71.99 52.57 0.24 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 119.757 3.243 . . . . 0.0 119.757 -166.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 18.9 p30 -104.08 -156.15 0.56 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.568 -1.957 . . . . 0.0 112.816 177.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.667 HG23 HD13 ' A' ' 35' ' ' LEU . 25.4 mm -68.67 -27.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 C-N-CA 125.626 1.57 . . . . 0.0 112.764 -177.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -61.8 -43.02 99.68 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 119.735 -1.853 . . . . 0.0 112.934 170.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.58 -23.9 66.95 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -173.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.3 mt -60.83 -35.75 77.34 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.65 -1.281 . . . . 0.0 113.576 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.488 HD21 HD12 ' A' ' 35' ' ' LEU . 16.4 mt -81.84 -17.42 47.47 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.102 0.961 . . . . 0.0 109.499 -175.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -82.26 -46.11 14.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.724 1.61 . . . . 0.0 112.75 170.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -63.2 -44.63 94.8 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.203 1.801 . . . . 0.0 113.288 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.91 78.57 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.941 1.297 . . . . 0.0 113.46 174.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -59.73 -43.55 94.13 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.716 1.206 . . . . 0.0 113.674 177.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -64.28 -47.82 78.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.454 1.902 . . . . 0.0 112.018 175.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.79 -32.66 73.39 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.235 1.569 . . . . 0.0 115.235 -176.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -51.55 -44.02 62.55 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 126.378 1.871 . . . . 0.0 113.628 171.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 -79.18 -43.85 23.1 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.251 1.02 . . . . 0.0 112.355 176.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -53.96 -43.23 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 62.7 tt0 -57.94 -37.11 73.51 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.272 1.429 . . . . 0.0 114.725 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 13.1 mmp_? -70.67 -39.13 73.73 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.219 -0.926 . . . . 0.0 112.838 177.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -73.27 -44.75 58.73 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.453 1.501 . . . . 0.0 113.325 176.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.21 -18.8 39.95 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.689 2.396 . . . . 0.0 115.637 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -58.48 -41.88 86.26 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 170.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 6.7 p-80 . . . . . 0 C--O 1.261 1.679 0 C-N-CA 123.654 0.782 . . . . 0.0 112.276 -169.829 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.327 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.6 p -64.83 154.86 35.87 Favored 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 -166.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -89.68 -63.0 1.35 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.774 1.23 . . . . 0.0 109.054 -176.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.8 m 77.59 29.02 0.55 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.215 1.806 . . . . 0.0 115.593 163.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.417 HG23 ' H ' ' A' ' 5' ' ' VAL . 22.0 t -51.49 -54.27 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 C-N-CA 127.54 2.336 . . . . 0.0 113.514 176.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -70.35 -27.33 64.27 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.489 -1.382 . . . . 0.0 114.097 -177.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -41.31 93.49 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.718 1.207 . . . . 0.0 108.396 173.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -77.26 -32.75 55.88 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.831 2.052 . . . . 0.0 110.093 -172.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -63.43 -33.05 74.7 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.721 1.208 . . . . 0.0 112.277 166.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.7 64.7 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.35 -1.469 . . . . 0.0 111.63 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.83 -53.35 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 126.022 1.729 . . . . 0.0 113.475 174.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -55.57 -36.89 67.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.62 1.568 . . . . 0.0 113.32 -176.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -65.13 -53.55 43.49 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 123.95 0.9 . . . . 0.0 112.899 174.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.5 t -60.17 -40.02 82.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 O-C-N 120.186 -1.571 . . . . 0.0 112.581 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.1 t-20 -58.41 -48.78 79.56 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 170.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -58.94 -39.22 80.97 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.399 -2.063 . . . . 0.0 112.923 175.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 49.4 mt -62.75 -51.76 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 126.552 1.941 . . . . 0.0 110.992 173.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -40.47 87.61 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.754 1.222 . . . . 0.0 113.089 178.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 46.5 m -71.56 -30.75 66.22 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.798 1.639 . . . . 0.0 113.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -86.61 -36.19 18.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.66 -1.9 . . . . 0.0 113.601 173.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -86.65 51.84 2.34 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.996 -1.69 . . . . 0.0 112.988 177.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -87.91 -36.78 16.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 0.0 112.042 170.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -71.38 -15.49 62.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.348 -0.845 . . . . 0.0 112.818 170.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -134.68 74.85 64.05 Favored Pre-proline 0 N--CA 1.431 -1.405 0 O-C-N 120.633 -1.292 . . . . 0.0 109.828 -178.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -72.14 -7.29 20.73 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 CA-C-N 123.872 2.418 . . . . 0.0 114.297 -169.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -80.14 -23.94 40.79 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.97 1.708 . . . . 0.0 111.471 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.415 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.4 mm -70.6 -43.15 77.9 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 O-C-N 120.433 -1.417 . . . . 0.0 110.079 -179.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -50.18 -46.22 54.15 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.96 2.104 . . . . 0.0 112.574 175.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 56.1 mtt180 -75.95 -47.31 25.63 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 174.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.6 m -68.67 -31.23 70.2 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.336 -1.478 . . . . 0.0 113.494 -169.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.302 0.2 OUTLIER -65.68 -34.78 78.99 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 173.04 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.25 -41.9 80.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.407 -1.433 . . . . 0.0 112.102 179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -50.26 -36.65 32.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.507 1.669 . . . . 0.0 115.507 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 48.2 mt -65.52 -47.63 85.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.221 1.409 . . . . 0.0 111.763 172.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.507 HD13 HG23 ' B' ' 202' ' ' ILE . 1.7 mt -67.02 -33.55 75.8 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 118.875 -2.391 . . . . 0.0 113.754 176.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -64.92 -26.16 68.19 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.378 1.871 . . . . 0.0 112.857 172.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -31.73 68.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.313 -1.492 . . . . 0.0 112.148 171.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -76.2 -61.36 1.97 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 121.154 -0.966 . . . . 0.0 111.803 164.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.547 ' HG2' HD23 ' B' ' 206' ' ' LEU 0.332 0.0 OUTLIER -80.0 -18.14 51.04 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 118.468 2.766 . . . . 0.0 118.468 -161.694 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -72.16 -56.58 5.32 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.203 -1.56 . . . . 0.0 112.444 173.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -46.8 -42.79 17.66 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.326 1.851 . . . . 0.0 114.601 -177.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -54.56 -23.48 16.93 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.693 1.997 . . . . 0.0 116.092 177.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.79 -27.73 69.09 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 118.944 -2.348 . . . . 0.0 113.725 174.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -116.02 26.12 10.19 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.903 -1.123 . . . . 0.0 113.242 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 40.7 p -95.43 164.5 12.79 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.18 -1.575 . . . . 0.0 112.824 175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 22.0 pttm -104.97 150.75 24.65 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 127.008 2.123 . . . . 0.0 107.747 169.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 83.46 -56.78 5.07 Favored Glycine 0 N--CA 1.43 -1.749 0 O-C-N 120.26 -1.525 . . . . 0.0 115.226 170.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 23.7 76.08 0.25 Allowed Pre-proline 0 N--CA 1.431 -1.406 0 C-N-CA 131.067 3.747 . . . . 0.0 119.029 -176.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_exo -80.19 14.05 2.04 Favored 'Trans proline' 0 N--CA 1.434 -2.012 0 C-N-CA 123.186 2.591 . . . . 0.0 116.796 -172.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.9 t80 63.18 120.13 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 128.564 2.746 . . . . 0.0 114.645 -169.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.9 ptt85 -159.69 -77.21 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.967 0.907 . . . . 0.0 110.005 173.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 95.81 58.81 1.09 Allowed Glycine 0 N--CA 1.43 -1.763 0 C-N-CA 124.59 1.091 . . . . 0.0 110.567 -171.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.367 0.0 OUTLIER 46.28 -133.14 1.02 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.219 2.208 . . . . 0.0 114.625 -179.33 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.1 p -91.64 127.4 37.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 122.986 1.374 . . . . 0.0 110.103 158.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -65.76 -25.94 67.49 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.728 -1.233 . . . . 0.0 110.77 173.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -50.57 -41.06 53.88 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.452 2.301 . . . . 0.0 114.51 167.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -84.19 -39.32 19.52 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 120.925 1.693 . . . . 0.0 111.274 -171.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.36 -32.14 56.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-O 123.7 1.714 . . . . 0.0 110.832 -177.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -61.47 -60.12 4.2 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 127.062 2.145 . . . . 0.0 113.476 160.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.264 0.4 OUTLIER -45.09 -48.16 11.98 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.984 2.513 . . . . 0.0 115.994 -176.69 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 45.8 mt-10 -77.07 -30.28 55.43 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.653 -1.28 . . . . 0.0 112.686 -177.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.55 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 94.1 t -73.79 -30.52 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.418 0 CA-C-O 124.795 2.236 . . . . 0.0 113.189 176.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.25 -38.95 91.92 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.224 -1.547 . . . . 0.0 110.34 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.4 p30 -69.35 -39.3 78.2 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -175.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.276 0.1 OUTLIER -79.97 -19.72 47.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.246 1.018 . . . . 0.0 113.204 -174.458 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.2 m-30 -93.9 -29.19 15.42 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.605 1.162 . . . . 0.0 111.555 177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -39.19 123.9 1.43 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 128.675 2.79 . . . . 0.0 116.928 -172.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.15 -45.53 1.25 Allowed Glycine 0 N--CA 1.431 -1.688 0 N-CA-C 108.889 -1.684 . . . . 0.0 108.889 -162.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -99.64 87.58 3.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.866 1.793 . . . . 0.0 110.72 173.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 48.4 mm-40 -74.8 -27.52 60.34 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.695 1.998 . . . . 0.0 113.497 -168.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -53.22 -41.27 65.19 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.005 2.522 . . . . 0.0 113.12 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.3 mt -67.53 -40.31 85.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.438 -1.414 . . . . 0.0 114.756 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.66 -20.95 59.67 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.774 -2.454 . . . . 0.0 113.703 -174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 35.8 t -57.41 -50.49 72.84 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.493 1.917 . . . . 0.0 110.652 169.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -75.11 -18.39 60.25 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 174.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -62.2 -21.79 65.4 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 120.24 -1.537 . . . . 0.0 113.843 176.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -65.34 -19.86 66.9 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.994 -1.691 . . . . 0.0 115.97 177.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -66.44 -23.8 66.35 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.084 -1.833 . . . . 0.0 113.975 175.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -87.85 -20.37 26.13 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.48 1.512 . . . . 0.0 112.023 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 67.7 mt -108.77 104.25 54.05 Favored Pre-proline 0 N--CA 1.43 -1.455 0 O-C-N 120.963 -1.086 . . . . 0.0 112.932 -173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -76.21 117.83 4.76 Favored 'Trans proline' 0 C--N 1.299 -2.032 0 C-N-CA 123.311 2.674 . . . . 0.0 113.716 -174.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -93.77 -54.57 3.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.631 1.205 . . . . 0.0 111.815 177.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.0 -51.29 0.14 Allowed 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.319 47.8 mtpt 78.45 23.22 0.68 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 128.052 2.541 . . . . 0.0 114.345 176.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.297 27.8 mmt180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 128.136 2.574 . . . . 0.0 115.888 173.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 73.9 t . . . . . 0 CA--C 1.489 -1.367 0 N-CA-C 111.361 0.134 . . . . 0.0 111.361 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 -69.19 98.34 1.01 Allowed 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -168.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.301 51.3 mtp 58.43 80.57 0.18 Allowed 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.828 2.851 . . . . 0.0 116.328 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -139.96 166.47 24.55 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.291 1.437 . . . . 0.0 107.602 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.507 HG23 HD13 ' A' ' 35' ' ' LEU . 11.9 mm -46.76 -35.91 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.819 2.448 . . . . 0.0 114.37 169.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -48.32 -34.58 10.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 172.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 57.4 mtp -67.44 -22.29 65.52 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.802 -1.811 . . . . 0.0 114.916 176.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 42.5 mt -68.8 -38.9 80.26 Favored 'General case' 0 N--CA 1.429 -1.498 0 N-CA-C 115.24 1.57 . . . . 0.0 115.24 -177.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.547 HD23 ' HG2' ' A' ' 39' ' ' GLN . 1.7 mm? -75.49 -19.66 59.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.19 -0.944 . . . . 0.0 111.501 178.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -81.58 -43.08 19.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 124.599 1.16 . . . . 0.0 111.176 177.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -65.64 -37.06 85.48 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.26 1.424 . . . . 0.0 112.72 172.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.41 -49.94 75.57 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 175.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -61.18 -40.22 93.11 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.754 -1.216 . . . . 0.0 113.244 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -59.02 -49.49 77.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.694 1.598 . . . . 0.0 113.061 172.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.79 -19.17 62.05 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.663 1.727 . . . . 0.0 115.663 -177.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -65.93 -52.05 53.24 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.123 -0.986 . . . . 0.0 111.984 163.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 -62.72 -28.67 70.12 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 19.3 mtp180 -56.75 -30.87 64.01 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 115.315 1.598 . . . . 0.0 115.315 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -76.03 -35.69 59.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.456 -1.403 . . . . 0.0 112.883 178.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 53.9 mtt180 -65.1 -26.28 68.14 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.294 -1.504 . . . . 0.0 113.943 176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -80.27 -19.62 46.34 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.15 1.537 . . . . 0.0 115.15 175.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -78.81 -18.49 54.0 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.797 -1.189 . . . . 0.0 112.572 175.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -57.61 -55.42 35.12 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.91 1.684 . . . . 0.0 115.54 -174.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.9 t60 . . . . . 0 C--O 1.261 1.676 0 C-N-CA 125.677 1.591 . . . . 0.0 114.519 176.65 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 . . . . . 0 CA--C 1.49 -1.346 0 CA-C-O 121.514 0.673 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.2 p -143.57 173.87 11.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.065 0.946 . . . . 0.0 109.376 172.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -120.7 130.0 53.89 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 107.548 -1.278 . . . . 0.0 107.548 167.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.4 m -117.47 34.74 4.99 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 120.065 -1.647 . . . . 0.0 112.23 -175.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.0 t -66.5 -54.08 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 126.342 1.857 . . . . 0.0 112.848 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.86 -17.73 57.04 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.669 0.787 . . . . 0.0 112.305 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -56.69 -51.17 69.82 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 122.586 0.355 . . . . 0.0 110.617 162.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.445 ' HA ' HG12 ' A' ' 11' ' ' ILE . 89.0 m-20 -73.75 -23.61 59.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.505 1.122 . . . . 0.0 111.575 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -73.84 -31.04 63.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.425 -1.422 . . . . 0.0 111.412 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.85 -46.02 76.35 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.186 0.994 . . . . 0.0 111.36 169.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.445 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.5 mm -54.67 -50.68 57.97 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.405 1.482 . . . . 0.0 113.549 176.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -50.0 -37.52 33.07 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.419 1.888 . . . . 0.0 114.509 -179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.27 -56.07 7.67 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.529 1.531 . . . . 0.0 111.627 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -63.14 -32.54 56.65 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 O-C-N 120.678 -1.264 . . . . 0.0 113.034 178.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -60.48 -40.99 93.26 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.823 -1.798 . . . . 0.0 115.245 169.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -65.07 -36.7 85.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.769 -1.832 . . . . 0.0 113.069 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 54.5 mt -62.88 -52.13 63.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.561 1.944 . . . . 0.0 112.021 171.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -43.96 84.07 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.071 1.348 . . . . 0.0 112.7 177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.1 m -66.16 -35.77 81.34 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.45 1.1 . . . . 0.0 112.9 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 40.1 ttm-85 -75.65 -50.35 15.7 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.062 -2.274 . . . . 0.0 113.499 171.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -83.97 44.87 1.03 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.163 -1.586 . . . . 0.0 113.983 -172.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.6 mt -74.62 -40.7 61.38 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.656 1.582 . . . . 0.0 110.545 171.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -78.12 -4.27 46.59 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.911 0.862 . . . . 0.0 112.483 174.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -135.16 70.08 69.31 Favored Pre-proline 0 N--CA 1.43 -1.449 0 O-C-N 119.259 -2.15 . . . . 0.0 111.378 179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -74.16 -5.37 16.86 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 CA-C-N 124.206 2.538 . . . . 0.0 114.651 -169.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -79.07 -17.62 54.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.62 1.968 . . . . 0.0 110.955 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.446 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.9 OUTLIER -71.05 -36.25 62.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 O-C-N 119.965 -1.709 . . . . 0.0 109.665 170.461 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -59.02 -37.37 76.76 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.695 1.198 . . . . 0.0 112.337 -177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.4 mmt85 -72.21 -59.2 2.85 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 167.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 68.7 m -70.34 -25.81 63.46 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.262 1.578 . . . . 0.0 115.262 -162.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -55.22 -55.95 25.51 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.004 1.321 . . . . 0.0 112.806 168.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 mt -69.57 -37.29 76.94 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.843 -1.161 . . . . 0.0 112.049 -174.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -49.53 -32.21 11.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 41.9 mt -69.33 -45.13 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 120.052 -1.655 . . . . 0.0 110.824 172.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.534 HD13 HG23 ' B' ' 202' ' ' ILE . 4.2 mt -66.88 -34.57 78.08 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.802 -1.812 . . . . 0.0 112.349 177.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -63.07 -30.62 71.74 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 128.308 2.643 . . . . 0.0 112.717 174.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -58.49 -37.11 74.87 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.152 1.781 . . . . 0.0 112.169 172.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.1 OUTLIER -74.21 -60.49 2.24 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.313 1.445 . . . . 0.0 111.73 172.341 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.57 -21.94 64.5 Favored 'General case' 0 N--CA 1.429 -1.507 0 N-CA-C 115.003 1.483 . . . . 0.0 115.003 -159.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -42.45 -40.61 2.63 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 129.784 3.234 . . . . 0.0 118.206 176.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 -79.82 -18.69 50.27 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -79.42 -70.87 0.48 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.051 -1.03 . . . . 0.0 112.394 -176.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 66.4 mt 52.12 -122.23 1.97 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.119 2.168 . . . . 0.0 114.521 -171.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 13.7 t-160 -100.51 85.49 2.96 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.335 -1.478 . . . . 0.0 109.527 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.0 t -74.06 137.32 43.27 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.575 1.178 . . . . 0.0 114.053 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -83.75 -59.86 2.3 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.05 1.74 . . . . 0.0 111.67 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -111.79 -58.86 0.45 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 121.37 -0.831 . . . . 0.0 112.703 -173.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -88.42 129.74 48.23 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 115.046 1.498 . . . . 0.0 115.046 -164.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -77.78 151.1 27.87 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 C-N-CA 122.549 2.166 . . . . 0.0 111.818 165.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -118.77 163.22 17.19 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 125.231 1.412 . . . . 0.0 111.502 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -108.43 -55.41 2.39 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.863 1.265 . . . . 0.0 111.223 177.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 140.73 -154.11 24.09 Favored Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 178.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.445 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -88.02 -138.6 0.11 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 163.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.9 m -74.45 121.85 22.1 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.907 -1.746 . . . . 0.0 110.583 167.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 50.1 mp0 -58.23 -35.27 71.45 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.628 1.571 . . . . 0.0 111.729 172.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.66 -18.44 65.32 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 116.173 1.916 . . . . 0.0 116.173 172.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -84.2 -35.26 23.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 122.229 2.286 . . . . 0.0 110.869 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -66.73 -33.63 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.831 1.3 . . . . 0.0 110.362 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -62.7 -56.72 15.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 128.225 2.61 . . . . 0.0 114.481 161.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -47.91 -43.59 29.03 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.051 2.14 . . . . 0.0 116.072 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.29 17.9 mt-10 -71.69 -53.88 12.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 121.173 -0.954 . . . . 0.0 111.581 179.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.498 ' HA ' HD13 ' A' ' 65' ' ' LEU . 85.4 t -50.25 -33.49 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.468 2.307 . . . . 0.0 115.042 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.28 -47.38 78.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.75 1.62 . . . . 0.0 111.706 176.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -73.71 -25.96 60.47 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.568 0.951 . . . . 0.0 113.568 -171.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.498 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.7 mp -63.33 -42.23 98.96 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.459 1.504 . . . . 0.0 111.926 172.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -94.75 -39.61 10.2 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.037 0.935 . . . . 0.0 111.387 -162.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.7 ppt_? -10.16 122.76 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.466 1 C-N-CA 131.916 4.087 . . . . 0.0 120.91 -170.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 136.63 -52.91 0.76 Allowed Glycine 0 N--CA 1.43 -1.738 0 N-CA-C 108.516 -1.833 . . . . 0.0 108.516 -169.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -105.6 117.48 34.14 Favored 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 123.111 1.434 . . . . 0.0 111.984 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -80.89 -18.52 46.98 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.67 1.588 . . . . 0.0 112.051 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -46.36 -46.29 18.25 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 130.488 3.515 . . . . 0.0 113.895 177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.0 mt -68.84 -47.57 65.65 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.607 -1.308 . . . . 0.0 112.864 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.75 -21.9 66.55 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.941 1.696 . . . . 0.0 112.414 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 3.3 t -65.54 -55.89 15.3 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.685 1.594 . . . . 0.0 110.564 177.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.11 -25.15 64.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 176.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.22 -27.23 67.82 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.57 1.148 . . . . 0.0 112.859 173.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -82.41 -17.32 69.11 Favored Glycine 0 N--CA 1.429 -1.771 0 C-N-CA 127.244 2.354 . . . . 0.0 115.533 -173.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -68.52 -45.41 72.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.156 1.478 . . . . 0.0 113.022 -162.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -98.22 -18.92 18.16 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.2 -176.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.327 1.0 OUTLIER -37.01 -71.55 0.11 Allowed Pre-proline 0 N--CA 1.43 -1.439 1 N-CA-C 121.999 4.074 . . . . 0.0 121.999 -170.798 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -80.69 176.18 9.32 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.839 3.026 . . . . 0.0 114.455 -169.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -57.01 -33.92 67.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -155.18 -108.04 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 176.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 15.4 tppt? -143.57 -55.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.994 -1.066 . . . . 0.0 110.388 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.285 59.2 mtt180 . . . . . 0 C--O 1.26 1.617 0 N-CA-C 115.95 1.833 . . . . 0.0 115.95 174.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 110.247 -0.279 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.6 ptp85 -90.13 139.94 30.15 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.441 -1.412 . . . . 0.0 111.372 179.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.8 ttp -100.5 -69.29 0.78 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 121.093 -1.004 . . . . 0.0 110.237 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.7 m120 50.12 -141.05 0.74 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.936 2.494 . . . . 0.0 112.856 -174.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.534 HG23 HD13 ' A' ' 35' ' ' LEU . 28.6 mm -81.62 -28.92 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 125.365 1.466 . . . . 0.0 111.594 168.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -53.23 -45.39 68.7 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.478 1.911 . . . . 0.0 116.12 -174.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 11.0 mtt -61.09 -22.15 64.36 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 175.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 95.2 mt -65.23 -33.63 76.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.423 -1.423 . . . . 0.0 113.602 -174.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 35' ' ' LEU . 5.8 mt -80.22 -19.86 45.98 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-O 122.095 0.95 . . . . 0.0 109.1 -173.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.436 4.0 pt-20 -83.62 -44.09 14.94 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 170.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.85 -41.88 92.4 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.021 1.328 . . . . 0.0 113.874 173.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.93 -40.27 92.58 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 176.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -43.82 93.76 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.946 2.498 . . . . 0.0 112.478 177.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 26.1 t80 -64.28 -47.53 79.17 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.463 1.905 . . . . 0.0 112.366 173.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.49 -23.36 64.56 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.589 1.7 . . . . 0.0 115.589 -177.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -61.71 -46.9 87.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 124.854 1.262 . . . . 0.0 112.996 164.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.9 mtt85 -69.03 -26.34 64.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.714 -1.241 . . . . 0.0 113.918 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -56.88 -34.56 67.98 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 169.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -64.63 -35.57 81.45 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 125.233 1.413 . . . . 0.0 113.958 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 59.3 mmt-85 -66.29 -41.4 89.84 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.433 1.493 . . . . 0.0 112.132 177.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.21 -30.61 67.74 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.681 -1.262 . . . . 0.0 113.572 177.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -72.31 -25.4 61.55 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.019 0.928 . . . . 0.0 113.369 171.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -42.11 75.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.16 1.384 . . . . 0.0 113.552 -173.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 2.6 p80 . . . . . 0 C--O 1.26 1.614 0 C-N-CA 124.32 1.048 . . . . 0.0 111.621 177.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 25.4 pt-20 . . . . . 0 CA--C 1.49 -1.331 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.0 m 72.76 174.18 0.29 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 127.852 2.461 . . . . 0.0 113.837 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -100.19 -98.83 0.24 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.203 -1.561 . . . . 0.0 109.044 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.6 p -105.15 88.08 2.78 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 124.276 1.988 . . . . 0.0 112.575 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.5 t -77.61 -52.56 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.736 2.015 . . . . 0.0 109.121 -176.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -72.87 -19.03 61.37 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -175.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -61.41 -45.36 94.66 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 122.113 -0.367 . . . . 0.0 111.751 164.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.471 ' HA ' HG12 ' A' ' 11' ' ' ILE . 27.1 m-80 -75.41 -27.17 58.93 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.563 1.545 . . . . 0.0 111.139 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -68.54 -29.84 68.5 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.463 -1.398 . . . . 0.0 112.452 168.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.92 -46.56 74.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 121.07 -1.019 . . . . 0.0 111.805 167.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.471 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.2 mm -55.9 -49.53 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 125.389 1.476 . . . . 0.0 113.576 176.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 m -60.59 -19.43 57.63 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 125.897 1.679 . . . . 0.0 114.643 177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -74.99 -59.42 2.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.938 -1.726 . . . . 0.0 111.247 168.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.8 t -60.01 -36.5 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 125.733 1.613 . . . . 0.0 113.764 -178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -58.57 -41.4 85.57 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.832 -1.793 . . . . 0.0 115.063 170.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -68.23 -37.7 81.09 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.74 -1.85 . . . . 0.0 112.262 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 74.1 mt -58.7 -50.25 79.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 C-N-CA 125.09 1.356 . . . . 0.0 111.772 173.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -53.24 -55.82 21.4 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.623 1.169 . . . . 0.0 113.739 172.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -78.27 -18.79 54.83 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -167.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -82.85 -49.01 10.13 Favored 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 119.14 -2.225 . . . . 0.0 111.806 165.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -80.85 52.51 1.74 Allowed 'General case' 0 N--CA 1.43 -1.442 0 CA-C-O 122.751 1.262 . . . . 0.0 112.978 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.4 mt -82.29 -35.74 27.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.977 -1.702 . . . . 0.0 110.104 167.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -69.27 -15.69 63.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.479 -0.763 . . . . 0.0 112.309 171.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -131.49 80.43 67.16 Favored Pre-proline 0 N--CA 1.43 -1.428 0 O-C-N 120.458 -1.401 . . . . 0.0 109.485 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.64 0.32 10.11 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 124.891 2.782 . . . . 0.0 113.863 -178.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.4 pt-20 -78.07 -31.38 50.18 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.176 1.353 . . . . 0.0 112.159 -176.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.9 mm -60.15 -37.8 74.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.831 2.452 . . . . 0.0 110.871 -174.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -50.43 -35.8 30.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.542 1.937 . . . . 0.0 115.087 173.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -82.17 -53.18 6.28 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.278 1.031 . . . . 0.0 110.348 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.4 p -79.89 -31.72 40.3 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -166.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.303 0.0 OUTLIER -64.58 -42.58 95.53 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-N 120.823 1.647 . . . . 0.0 114.246 177.696 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 mt -73.53 -33.58 64.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.371 -1.456 . . . . 0.0 113.151 179.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.0 tt0 -44.39 -44.36 8.26 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 168.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.679 HG22 HG23 ' A' ' 58' ' ' VAL . 22.9 mt -64.73 -48.55 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.401 1.88 . . . . 0.0 112.177 171.456 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -62.32 -30.43 71.15 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.708 -2.495 . . . . 0.0 115.518 175.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.407 ' CE1' HD12 ' B' ' 206' ' ' LEU . 90.5 m-70 -70.22 -27.85 64.8 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 119.081 -2.262 . . . . 0.0 112.286 173.475 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.35 -33.47 71.2 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.391 1.476 . . . . 0.0 112.129 172.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -74.96 -61.46 1.88 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.133 1.773 . . . . 0.0 112.404 171.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -72.71 -20.86 61.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -158.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -47.53 -47.06 28.15 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.668 1.987 . . . . 0.0 114.84 172.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -81.85 -57.52 3.39 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.094 0.958 . . . . 0.0 111.57 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 64.94 -44.33 0.33 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 129.24 3.016 . . . . 0.0 116.872 -175.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.6 mt -84.36 145.91 27.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.605 -1.309 . . . . 0.0 113.36 -164.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.6 m80 -94.71 80.9 3.79 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.332 -1.48 . . . . 0.0 109.631 174.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.2 p -117.13 153.47 32.73 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-O 122.865 1.317 . . . . 0.0 113.216 -171.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -87.96 118.28 27.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.057 1.343 . . . . 0.0 108.876 167.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 142.84 -55.5 0.58 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 42.8 ptt85 -76.11 155.11 84.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 120.787 -1.419 . . . . 0.0 114.026 -173.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -81.09 -168.57 0.64 Allowed 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 122.647 2.232 . . . . 0.0 111.63 162.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.45 -138.74 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.458 1 C-N-CA 132.177 4.191 . . . . 0.0 120.139 172.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 56.8 mtm180 74.75 -68.65 0.21 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.255 2.622 . . . . 0.0 112.169 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.92 122.32 5.71 Favored Glycine 0 N--CA 1.43 -1.749 0 N-CA-C 108.843 -1.703 . . . . 0.0 108.843 176.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.64 -139.98 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -149.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.3 m -113.4 145.92 40.35 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.078 1.351 . . . . 0.0 110.674 178.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -47.74 -47.91 30.1 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.713 2.405 . . . . 0.0 114.867 177.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -48.43 -28.07 3.04 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 117.776 2.509 . . . . 0.0 117.776 172.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -41.07 17.78 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.164 -2.21 . . . . 0.0 108.6 -177.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.679 HG23 HG22 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -68.82 -39.68 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 122.507 1.146 . . . . 0.0 110.625 -174.175 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.68 -49.4 70.73 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.799 2.04 . . . . 0.0 113.6 165.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.04 -44.06 78.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.711 1.204 . . . . 0.0 113.843 176.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.542 ' O ' HD12 ' A' ' 65' ' ' LEU 0.372 23.2 mt-10 -76.79 -44.54 32.38 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 117.734 -1.127 . . . . 0.0 112.708 -178.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.451 HG21 HD21 ' A' ' 35' ' ' LEU . 76.0 t -54.39 -35.78 32.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 CA-C-N 121.587 1.994 . . . . 0.0 114.385 172.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.29 -32.09 73.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 125.309 1.443 . . . . 0.0 112.476 178.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -72.11 -32.99 67.49 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.312 -0.867 . . . . 0.0 112.103 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.542 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.8 mp -70.72 -42.6 70.36 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 122.325 1.06 . . . . 0.0 112.801 176.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -89.27 -7.93 54.45 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.023 1.729 . . . . 0.0 110.944 -169.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -48.54 132.72 17.11 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 129.496 3.119 . . . . 0.0 115.938 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.0 -46.38 1.17 Allowed Glycine 0 N--CA 1.43 -1.742 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -172.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -92.42 92.24 8.02 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.496 1.617 . . . . 0.0 112.436 -176.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.78 -20.32 46.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.57 1.548 . . . . 0.0 113.357 -169.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -46.16 -41.49 12.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 129.846 3.259 . . . . 0.0 113.053 175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.0 mt -80.12 -41.35 25.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.483 -1.386 . . . . 0.0 113.958 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.7 -19.26 60.87 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 118.805 -2.434 . . . . 0.0 113.853 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 22.8 t -57.85 -51.26 70.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.751 2.021 . . . . 0.0 111.054 170.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -74.45 -21.19 59.72 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.156 1.782 . . . . 0.0 114.822 175.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -58.41 -29.28 65.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 O-C-N 120.707 -1.245 . . . . 0.0 112.466 174.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.66 -18.35 71.98 Favored Glycine 0 N--CA 1.429 -1.828 0 C-N-CA 127.088 2.28 . . . . 0.0 115.876 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -74.53 -22.53 58.98 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.009 1.904 . . . . 0.0 112.476 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -93.73 -5.04 49.33 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.189 1.396 . . . . 0.0 110.108 177.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.1 mt -108.74 170.77 5.1 Favored Pre-proline 0 N--CA 1.43 -1.448 0 O-C-N 120.917 -1.115 . . . . 0.0 111.935 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -64.39 146.32 89.53 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 C-N-CA 122.348 2.032 . . . . 0.0 114.805 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 21.6 pt-20 -60.19 -46.94 87.99 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -162.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.08 -40.87 0.06 Allowed 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.152 -1.592 . . . . 0.0 110.744 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.268 41.6 mtpt 75.18 45.01 0.15 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 129.163 2.985 . . . . 0.0 111.825 -179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 12.0 mtm180 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.797 1.239 . . . . 0.0 112.153 -177.368 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.49 -1.339 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 62.2 -147.21 0.39 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.622 1.169 . . . . 0.0 113.905 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 16.9 ttt -36.35 103.79 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.332 2.653 . . . . 0.0 117.512 175.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -158.06 -177.86 6.87 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.966 -1.084 . . . . 0.0 108.69 -174.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.17 -34.51 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.828 2.051 . . . . 0.0 113.444 -176.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -44.52 -37.3 3.43 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 117.342 2.349 . . . . 0.0 117.342 173.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 4.9 mtp -69.86 -18.6 63.44 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 176.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 90.7 mt -66.08 -35.71 81.26 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.647 -1.908 . . . . 0.0 114.797 178.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.621 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -72.61 -22.47 60.96 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.593 1.557 . . . . 0.0 111.346 178.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -81.19 -53.39 6.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.262 1.425 . . . . 0.0 111.487 174.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.24 88.18 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.911 1.684 . . . . 0.0 113.543 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.88 81.26 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.244 1.572 . . . . 0.0 115.244 175.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -71.75 -43.85 65.08 Favored 'General case' 0 CA--C 1.489 -1.394 0 CA-C-O 122.614 1.197 . . . . 0.0 111.563 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -57.25 -47.46 81.34 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 126.242 1.817 . . . . 0.0 113.079 173.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.9 mt -69.24 -32.08 71.06 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.188 1.551 . . . . 0.0 115.188 -177.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -55.42 -48.37 74.5 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.986 1.314 . . . . 0.0 113.088 168.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 4.4 ttt-85 -64.83 -39.99 94.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.855 1.262 . . . . 0.0 113.56 178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 51.7 ttt180 -55.12 -43.46 74.09 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.288 1.835 . . . . 0.0 114.479 174.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.5 -30.68 66.24 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.406 1.483 . . . . 0.0 113.949 176.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 46.8 mtt-85 -64.85 -41.67 95.51 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.384 -1.448 . . . . 0.0 113.847 170.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -73.71 -21.03 60.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.462 -2.023 . . . . 0.0 114.499 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.75 -17.35 62.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 167.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -58.5 -18.0 25.67 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.596 2.073 . . . . 0.0 116.596 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.26 1.645 0 N-CA-C 117.326 2.343 . . . . 0.0 117.326 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 . . . . . 0 CA--C 1.49 -1.359 0 N-CA-C 105.42 -2.067 . . . . 0.0 105.42 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 56.7 p -108.71 103.94 13.13 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.916 -1.115 . . . . 0.0 111.736 -170.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -85.85 -84.03 0.17 Allowed 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.855 -1.153 . . . . 0.0 111.153 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.3 m -138.1 29.42 2.51 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 122.487 1.137 . . . . 0.0 111.441 -164.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 55.7 t -61.38 -49.42 84.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.702 2.001 . . . . 0.0 110.417 177.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -70.21 -18.49 63.17 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.823 1.416 . . . . 0.0 114.823 177.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -66.93 -42.7 84.9 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.006 -1.059 . . . . 0.0 110.143 168.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.495 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.9 m-80 -76.37 -25.81 55.01 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 127.393 2.277 . . . . 0.0 112.391 -176.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -75.98 -23.07 55.27 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.198 -0.939 . . . . 0.0 111.984 172.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.85 -41.21 65.01 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.649 -1.282 . . . . 0.0 112.478 164.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.495 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.4 mm -57.89 -49.21 81.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.424 1.49 . . . . 0.0 113.86 176.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.5 p -54.93 -35.38 64.12 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.101 1.36 . . . . 0.0 113.972 -176.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -61.08 -55.87 27.6 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.451 1.501 . . . . 0.0 111.937 174.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -63.04 -38.57 82.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 C-N-CA 125.286 1.434 . . . . 0.0 112.52 179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -58.55 -42.95 89.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.804 1.779 . . . . 0.0 115.804 170.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.415 ' HZ1' ' CG ' ' A' ' 71' ' ' ASP . 31.9 mtpt -61.71 -43.94 97.89 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.375 -1.453 . . . . 0.0 112.646 172.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 59.6 mt -55.49 -49.94 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.581 1.552 . . . . 0.0 111.807 175.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.4 mtmt -61.23 -43.81 98.27 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 47.1 m -60.43 -29.35 68.94 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.777 1.769 . . . . 0.0 115.777 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 21.1 mmt180 -93.59 -26.9 16.9 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 119.66 -1.9 . . . . 0.0 114.077 169.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -91.99 47.06 1.31 Allowed 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.909 -1.744 . . . . 0.0 113.405 177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 81.1 mt -82.45 -29.38 30.7 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.372 -1.455 . . . . 0.0 111.733 175.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -79.57 -15.23 58.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.507 -0.746 . . . . 0.0 112.022 172.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 -132.31 79.95 64.61 Favored Pre-proline 0 N--CA 1.431 -1.405 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 -172.078 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_exo -68.97 -3.8 12.2 Favored 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.924 2.416 . . . . 0.0 115.504 176.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' HD13 ' A' ' 27' ' ' ILE . 8.7 mt-10 -69.29 -31.98 70.84 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.108 1.763 . . . . 0.0 110.133 -178.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -75.13 -36.47 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 -171.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 12.9 t80 -62.36 -41.64 98.77 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.814 1.246 . . . . 0.0 111.594 173.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.8 mmm180 -64.07 -41.91 97.16 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.651 -1.281 . . . . 0.0 113.986 172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 36.7 t -79.36 -45.64 19.19 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.623 1.169 . . . . 0.0 113.442 -171.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.317 0.1 OUTLIER -63.38 -44.13 95.61 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.016 1.858 . . . . 0.0 116.016 -173.041 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.13 -33.99 74.32 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.405 -1.434 . . . . 0.0 112.635 -178.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -48.28 -39.5 21.85 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 115.725 1.75 . . . . 0.0 115.725 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.6 mt -69.23 -44.04 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.912 1.685 . . . . 0.0 111.353 171.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.521 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.5 mt -68.65 -18.78 64.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.454 -2.029 . . . . 0.0 113.716 176.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -70.17 -29.15 65.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 118.378 -2.701 . . . . 0.0 112.387 170.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -64.32 -21.0 66.46 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.12 -1.612 . . . . 0.0 113.134 172.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -78.2 -61.43 2.0 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.115 1.766 . . . . 0.0 111.929 163.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.62 -19.19 60.4 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.219 2.303 . . . . 0.0 117.219 -164.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.8 mmmt -64.5 -45.48 87.09 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 119.744 -1.848 . . . . 0.0 112.343 170.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -63.03 -40.93 99.2 Favored 'General case' 0 N--CA 1.429 -1.514 0 N-CA-C 114.34 1.237 . . . . 0.0 114.34 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -74.43 -25.96 59.76 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -173.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mt -6.7 76.88 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 131.034 3.734 . . . . 0.0 120.188 -176.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 81.5 t60 39.05 54.78 2.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 128.768 2.827 . . . . 0.0 115.064 -177.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 t -73.68 139.12 45.17 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.964 -1.085 . . . . 0.0 113.732 -168.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -95.18 142.91 27.06 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.847 -1.158 . . . . 0.0 110.507 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 114.11 -103.44 1.31 Allowed Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -177.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -93.8 166.67 15.32 Favored Pre-proline 0 N--CA 1.429 -1.482 0 C-N-CA 124.351 1.061 . . . . 0.0 111.716 178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -75.11 160.82 39.36 Favored 'Trans proline' 0 C--N 1.3 -2.019 0 C-N-CA 122.045 1.83 . . . . 0.0 111.668 160.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -127.65 158.36 37.77 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.062 0.945 . . . . 0.0 108.476 178.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -99.5 -78.44 0.5 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 160.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.28 -133.29 4.17 Favored Glycine 0 N--CA 1.429 -1.777 0 N-CA-C 106.091 -2.804 . . . . 0.0 106.091 -176.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.6 ptt? -67.35 -157.96 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 127.068 2.147 . . . . 0.0 114.328 165.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 69.4 m -85.33 128.53 34.73 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.173 -2.205 . . . . 0.0 108.909 172.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -71.23 -19.11 62.41 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.474 -1.391 . . . . 0.0 112.061 -171.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -47.28 -39.38 14.41 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.334 2.254 . . . . 0.0 116.853 158.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -84.21 -34.74 23.85 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.124 -2.235 . . . . 0.0 111.514 -165.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -34.07 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 CA-C-O 123.034 1.397 . . . . 0.0 110.08 -179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 45.4 t80 -63.11 -55.58 24.1 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.933 2.493 . . . . 0.0 113.43 162.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.29 -44.16 43.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.272 2.229 . . . . 0.0 115.429 -178.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.265 29.0 mm-40 -73.07 -44.15 60.97 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.891 -1.131 . . . . 0.0 112.372 -179.354 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.49 ' HA ' HD13 ' A' ' 65' ' ' LEU . 72.4 t -59.41 -28.5 39.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 C-N-CA 126.241 1.816 . . . . 0.0 113.639 174.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.48 -33.61 75.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.631 1.573 . . . . 0.0 112.034 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -67.94 -37.02 81.11 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.067 0.936 . . . . 0.0 111.1 -179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.49 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.4 mp -67.15 -38.66 85.88 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.307 1.443 . . . . 0.0 112.244 -174.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 12.3 m-30 -100.59 11.74 38.85 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.221 1.408 . . . . 0.0 110.245 -165.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.275 0.0 OUTLIER -65.11 118.96 9.95 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -162.253 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.3 -20.05 10.58 Favored Glycine 0 N--CA 1.431 -1.685 0 C-N-CA 124.506 1.05 . . . . 0.0 111.147 -173.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -103.81 108.81 20.28 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 121.398 -1.06 . . . . 0.0 109.837 170.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -81.01 -24.38 37.99 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.122 -1.611 . . . . 0.0 112.234 174.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.415 ' CG ' ' HZ1' ' A' ' 16' ' ' LYS . 23.8 t0 -50.83 -50.46 56.57 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 128.768 2.827 . . . . 0.0 113.007 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 62.7 mt -66.57 -34.93 78.99 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.446 -1.409 . . . . 0.0 114.714 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -80.17 -20.59 44.45 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 118.997 -2.314 . . . . 0.0 112.088 178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 39.5 p -65.75 -47.31 75.67 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.201 1.4 . . . . 0.0 112.541 178.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -73.91 -19.04 60.82 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.578 1.551 . . . . 0.0 112.544 176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.456 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -65.19 -29.48 70.3 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 123.353 1.549 . . . . 0.0 111.617 169.18 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.96 -17.31 67.47 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 128.524 2.964 . . . . 0.0 116.41 -177.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -64.67 -25.66 68.05 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -171.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -97.64 -57.3 2.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.512 0.725 . . . . 0.0 110.527 160.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.333 16.7 mt -41.11 -65.13 0.5 Allowed Pre-proline 0 N--CA 1.43 -1.436 1 N-CA-C 122.365 4.209 . . . . 0.0 122.365 -148.937 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -69.94 126.64 13.42 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 CA-C-N 124.642 2.694 . . . . 0.0 112.448 176.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -71.19 -53.63 13.77 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 -165.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -130.78 -41.43 1.17 Allowed 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.902 -1.124 . . . . 0.0 109.878 -175.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.5 tttp 69.77 36.45 2.08 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.134 1.774 . . . . 0.0 114.404 170.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 19.0 mtm180 . . . . . 0 C--O 1.26 1.633 0 O-C-N 120.145 -1.597 . . . . 0.0 112.634 178.843 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.489 -1.378 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 7.2 ptt180 -146.48 162.17 38.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.394 -1.441 . . . . 0.0 108.015 172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.3 40.0 mmm 70.26 0.51 3.2 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -73.75 174.33 8.57 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.247 -1.533 . . . . 0.0 113.323 178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.456 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.291 4.5 mt -55.34 -24.25 15.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -169.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -52.35 -31.07 31.8 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.657 2.095 . . . . 0.0 116.657 171.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 75.3 mmm -62.07 -27.9 69.23 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.963 1.705 . . . . 0.0 114.764 173.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 72.3 mt -71.63 -33.95 69.39 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.743 -1.848 . . . . 0.0 115.056 -172.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.521 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.07 -24.96 59.57 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.6 1.16 . . . . 0.0 109.925 177.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 36.8 mm-40 -76.23 -47.26 24.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.895 -1.128 . . . . 0.0 110.416 176.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.82 -43.68 90.7 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.461 1.504 . . . . 0.0 113.162 174.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.31 -52.41 65.76 Favored 'General case' 0 CA--C 1.489 -1.376 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 175.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -72.96 -21.04 60.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.307 -1.496 . . . . 0.0 114.195 -178.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 21.8 t80 -66.17 -50.5 63.71 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.262 1.825 . . . . 0.0 111.8 165.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 3.6 mt -69.1 -23.58 64.02 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.649 1.58 . . . . 0.0 114.791 -176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -58.89 -47.39 85.15 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 125.657 1.583 . . . . 0.0 113.037 168.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -72.59 -41.43 65.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.021 0.929 . . . . 0.0 111.939 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.8 ttp85 -54.02 -37.99 64.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -176.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -75.5 -32.24 60.47 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.215 2.206 . . . . 0.0 115.042 176.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -34.95 67.95 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.446 -1.409 . . . . 0.0 111.588 171.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -65.17 -36.22 83.54 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.116 1.766 . . . . 0.0 114.565 173.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -60.88 -16.87 46.58 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 128.411 2.684 . . . . 0.0 116.316 173.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -56.6 -28.36 60.19 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.245 1.818 . . . . 0.0 114.933 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 . . . . . 0 C--O 1.26 1.635 0 O-C-N 121.214 -0.929 . . . . 0.0 108.912 163.667 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 . . . . . 0 CA--C 1.49 -1.332 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 m 78.05 137.65 0.06 Allowed 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 128.233 2.613 . . . . 0.0 115.72 171.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -70.43 -57.78 4.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.015 -1.678 . . . . 0.0 113.167 176.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -103.78 82.14 1.97 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 124.273 1.987 . . . . 0.0 110.656 -169.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.5 t -81.26 -46.91 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 C-N-CA 130.974 3.709 . . . . 0.0 110.022 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.265 31.1 mt-10 -74.59 -17.43 60.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.804 -1.185 . . . . 0.0 113.088 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.413 ' CE1' HD11 ' A' ' 11' ' ' ILE . 10.4 t80 -60.0 -46.52 89.22 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 123.718 0.807 . . . . 0.0 111.739 161.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -73.11 -34.4 66.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.307 2.243 . . . . 0.0 111.429 -175.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -64.86 -33.12 75.26 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.753 -1.217 . . . . 0.0 111.864 171.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -47.02 69.72 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 123.676 0.791 . . . . 0.0 111.878 170.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.413 HD11 ' CE1' ' A' ' 7' ' ' PHE . 10.5 mm -51.88 -52.07 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 125.798 1.639 . . . . 0.0 112.858 174.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.0 t -51.15 -43.64 61.28 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.233 2.213 . . . . 0.0 112.706 177.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.0 t80 -65.55 -51.89 56.52 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.294 1.037 . . . . 0.0 113.2 177.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.7 t -61.53 -37.49 77.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 O-C-N 120.562 -1.336 . . . . 0.0 112.02 177.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -56.61 -43.52 80.26 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.852 1.797 . . . . 0.0 115.852 169.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -42.72 94.78 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.071 1.748 . . . . 0.0 111.722 175.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 73.4 mt -57.77 -52.17 61.12 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 C-N-CA 127.598 2.359 . . . . 0.0 112.64 172.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.09 -42.88 81.53 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.967 1.307 . . . . 0.0 113.936 178.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.0 m -66.45 -22.28 66.2 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.889 1.276 . . . . 0.0 113.07 176.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -97.2 2.4 50.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.392 -2.068 . . . . 0.0 114.772 169.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -99.93 25.53 7.25 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 120.335 -1.478 . . . . 0.0 110.986 175.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.9 mt -73.42 -34.65 65.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 118.747 -2.47 . . . . 0.0 113.723 -176.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -85.39 -10.42 56.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.246 1.418 . . . . 0.0 111.279 168.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -126.74 59.34 33.49 Favored Pre-proline 0 N--CA 1.43 -1.456 0 O-C-N 120.024 -1.672 . . . . 0.0 114.914 -165.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -79.44 -29.6 2.93 Favored 'Trans proline' 0 C--N 1.299 -2.058 0 CA-C-N 124.882 2.779 . . . . 0.0 114.182 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -62.71 -30.65 71.57 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 123.746 1.736 . . . . 0.0 112.09 -174.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.533 HG23 HD23 ' A' ' 65' ' ' LEU . 2.8 mt -55.36 -31.57 27.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.346 2.658 . . . . 0.0 114.678 173.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -63.19 -24.12 67.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.683 -1.261 . . . . 0.0 112.617 177.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.86 -49.77 19.33 Favored 'General case' 0 N--CA 1.432 -1.364 0 O-C-N 120.04 -1.663 . . . . 0.0 112.658 167.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.3 t -76.74 -38.15 54.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -167.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.52 -50.9 22.34 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.076 1.75 . . . . 0.0 114.417 174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.417 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER -79.23 -34.94 42.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.603 -1.31 . . . . 0.0 113.308 -175.123 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -52.29 -38.04 57.25 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 173.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 70.9 mt -62.77 -50.91 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.507 1.523 . . . . 0.0 111.455 171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.734 ' HB2' HD11 ' B' ' 206' ' ' LEU . 0.6 OUTLIER -69.13 -23.01 63.92 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.943 -2.348 . . . . 0.0 116.048 177.188 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -70.0 -27.99 65.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.126 -2.234 . . . . 0.0 112.94 172.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.8 -29.18 70.41 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.466 1.507 . . . . 0.0 112.715 171.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -76.38 -61.44 1.95 Allowed 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.029 1.332 . . . . 0.0 112.041 170.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.422 HE22 HD21 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -67.8 -23.25 65.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.578 1.696 . . . . 0.0 115.578 -162.936 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -41.88 -49.3 4.51 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 127.679 2.392 . . . . 0.0 116.619 172.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -66.44 -19.29 65.76 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.268 1.427 . . . . 0.0 114.667 -175.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -89.2 -10.68 46.17 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.805 -1.184 . . . . 0.0 113.038 178.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.422 HD21 HE22 ' A' ' 39' ' ' GLN . 66.7 mt -86.58 -147.89 0.13 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.807 1.243 . . . . 0.0 111.233 178.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.0 t-80 -113.63 56.68 0.69 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.314 -2.116 . . . . 0.0 110.501 -173.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.5 t -97.23 -38.91 9.51 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.952 -1.092 . . . . 0.0 111.284 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.0 tpmt? -127.18 -66.43 0.89 Allowed 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 121.121 -0.987 . . . . 0.0 109.753 -178.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 50.51 0.62 Allowed Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 125.339 1.447 . . . . 0.0 113.723 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -111.88 149.58 41.04 Favored Pre-proline 0 N--CA 1.429 -1.485 0 CA-C-O 117.633 -1.175 . . . . 0.0 109.982 167.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.22 118.06 5.36 Favored 'Trans proline' 0 N--CA 1.433 -2.044 0 C-N-CA 123.181 2.587 . . . . 0.0 111.283 174.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -155.7 167.86 29.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -161.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mtm-85 -104.66 -62.58 1.31 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.289 1.036 . . . . 0.0 108.947 170.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.67 -74.87 0.11 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.585 -1.322 . . . . 0.0 111.795 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -165.82 -136.15 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 127.387 2.275 . . . . 0.0 108.153 -164.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 75.4 m -91.56 117.88 30.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 121.101 -0.999 . . . . 0.0 111.146 163.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 59.3 mp0 -55.15 -32.56 62.21 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.046 1.738 . . . . 0.0 112.432 167.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.5 mp0 -67.33 -20.04 65.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.239 -1.538 . . . . 0.0 113.579 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.47 -36.28 22.4 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 121.461 1.937 . . . . 0.0 111.216 -179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.6 -36.46 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 CA-C-O 123.366 1.555 . . . . 0.0 110.698 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -58.75 -56.52 21.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.966 2.507 . . . . 0.0 113.819 161.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.16 -41.27 65.01 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 116.098 1.888 . . . . 0.0 116.098 -177.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.275 23.5 mm-40 -72.6 -51.88 17.8 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.368 -0.832 . . . . 0.0 111.683 178.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.481 ' HA ' HD13 ' A' ' 65' ' ' LEU . 95.9 t -55.43 -29.23 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 127.146 2.178 . . . . 0.0 114.526 178.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.95 -39.21 88.65 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.282 1.833 . . . . 0.0 112.277 176.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -68.43 -33.33 74.01 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 121.869 0.842 . . . . 0.0 111.2 -176.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.533 HD23 HG23 ' A' ' 27' ' ' ILE . 8.2 mp -63.23 -47.67 81.49 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.822 1.649 . . . . 0.0 112.122 -176.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -92.78 -19.81 21.38 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.924 0.89 . . . . 0.0 111.209 -168.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 20.0 ttt-85 -21.9 119.41 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 130.481 3.513 . . . . 0.0 120.012 -166.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.3 -29.78 7.42 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 126.034 1.778 . . . . 0.0 110.873 -173.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -88.91 74.19 8.25 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 123.464 1.602 . . . . 0.0 112.479 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -72.23 -19.11 61.77 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.281 1.832 . . . . 0.0 113.62 -172.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.08 -40.96 67.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.082 2.153 . . . . 0.0 113.401 168.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.8 mt -76.05 -43.21 44.94 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.816 -1.177 . . . . 0.0 112.291 -177.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -67.1 -21.64 65.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.314 1.53 . . . . 0.0 112.829 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 7.6 t -65.06 -52.85 53.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.919 1.687 . . . . 0.0 110.82 173.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -70.38 -18.88 63.05 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -62.42 -26.63 68.59 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.076 1.35 . . . . 0.0 111.878 169.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.31 -18.81 58.83 Favored Glycine 0 N--CA 1.43 -1.739 0 C-N-CA 126.583 2.04 . . . . 0.0 115.442 176.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -75.6 -28.24 58.81 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.052 -1.852 . . . . 0.0 112.011 174.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -84.36 -12.96 53.58 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 125.733 1.613 . . . . 0.0 109.782 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.4 102.9 53.37 Favored Pre-proline 0 N--CA 1.43 -1.462 0 C-N-CA 124.515 1.126 . . . . 0.0 112.155 177.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -68.97 105.76 1.41 Allowed 'Trans proline' 0 N--CA 1.433 -2.038 0 C-N-CA 123.065 2.51 . . . . 0.0 114.132 178.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.32 -42.08 31.79 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.079 -1.638 . . . . 0.0 113.807 177.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -132.81 -35.9 1.07 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.886 -1.134 . . . . 0.0 111.07 -173.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.308 47.3 mttm 100.18 9.33 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.471 1 C-N-CA 131.778 4.031 . . . . 0.0 112.039 -175.499 . . . . . . . . 3 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.286 38.3 mtm180 . . . . . 0 C--O 1.26 1.616 0 C-N-CA 129.653 3.181 . . . . 0.0 113.998 178.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 10.3 p . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 120.543 0.211 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.8 ptp180 -144.24 153.04 41.64 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.888 -1.132 . . . . 0.0 112.032 -171.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 32.4 tpp -91.13 137.45 32.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.685 1.594 . . . . 0.0 111.664 174.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -160.63 179.32 8.66 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 102.79 -3.041 . . . . 0.0 102.79 166.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.579 HG23 HD13 ' A' ' 35' ' ' LEU . 7.9 mm -56.67 -26.94 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 127.964 2.506 . . . . 0.0 113.431 175.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -39.63 -44.85 1.56 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.75 2.82 . . . . 0.0 117.914 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -70.23 -20.13 63.1 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 43.6 mt -60.13 -36.53 77.7 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.633 -1.917 . . . . 0.0 115.423 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.734 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -71.86 -28.78 63.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 123.556 0.743 . . . . 0.0 112.404 178.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.283 6.3 pt-20 -83.24 -40.62 19.38 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.04 -44.38 94.69 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.583 1.553 . . . . 0.0 113.575 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.61 -44.54 77.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -40.26 64.49 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.403 -0.81 . . . . 0.0 112.337 -177.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -53.11 -52.81 57.44 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 127.326 2.25 . . . . 0.0 111.762 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . 0.252 41.9 tp -78.97 -26.81 43.42 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.285 -1.51 . . . . 0.0 113.084 -172.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.75 -44.39 93.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.435 1.494 . . . . 0.0 112.095 165.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 7.3 ttt180 -67.75 -29.26 68.43 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.613 1.565 . . . . 0.0 114.577 173.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 23.9 ttt180 -68.35 -31.88 71.58 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.19 -30.02 57.87 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.212 -1.555 . . . . 0.0 112.273 172.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -68.27 -28.95 67.64 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.595 -1.315 . . . . 0.0 114.086 170.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -60.26 -24.63 65.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.291 2.236 . . . . 0.0 115.885 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -64.39 -21.53 66.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.421 1.488 . . . . 0.0 115.015 177.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 55.2 mm-40 -69.76 -22.1 63.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.837 1.791 . . . . 0.0 115.837 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 14.9 p80 . . . . . 0 C--O 1.26 1.619 0 O-C-N 120.698 -1.251 . . . . 0.0 111.034 -179.085 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 . . . . . 0 CA--C 1.491 -1.311 0 CA-C-O 122.525 1.155 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.8 m -68.95 143.98 54.28 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.653 -1.904 . . . . 0.0 114.08 -173.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -91.89 -59.16 2.18 Favored 'General case' 0 N--CA 1.429 -1.487 0 CA-C-O 122.452 1.12 . . . . 0.0 109.675 -177.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.0 p -92.27 88.14 6.34 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.35 2.024 . . . . 0.0 114.434 -170.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.5 t -76.64 -45.4 32.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 127.471 2.308 . . . . 0.0 109.301 -178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -67.13 -25.57 66.25 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.281 -0.887 . . . . 0.0 113.342 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -66.89 -39.38 87.46 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.801 -0.562 . . . . 0.0 111.419 168.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.419 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.5 m-20 -75.77 -31.32 59.45 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.105 -0.997 . . . . 0.0 110.105 -174.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -62.33 -33.04 73.92 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.156 -0.965 . . . . 0.0 113.257 166.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.22 67.45 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.211 -0.931 . . . . 0.0 112.369 168.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.419 HG12 ' HA ' ' A' ' 8' ' ' ASN . 7.8 mm -55.97 -53.1 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.093 1.357 . . . . 0.0 113.262 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 t -55.44 -33.03 63.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.836 2.055 . . . . 0.0 114.183 -177.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -68.54 -53.68 21.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.151 1.78 . . . . 0.0 112.625 171.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 27.2 t -60.13 -40.36 83.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 126.03 1.732 . . . . 0.0 112.646 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -49.14 -51.46 32.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.051 1.741 . . . . 0.0 114.553 168.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 28.5 ttmt -59.39 -46.11 89.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.341 1.856 . . . . 0.0 113.65 175.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.1 mt -58.17 -47.32 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 126.584 1.954 . . . . 0.0 113.006 174.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -56.7 -50.38 72.32 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 121.013 -1.054 . . . . 0.0 112.34 175.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.8 m -66.1 -40.68 90.94 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.017 1.327 . . . . 0.0 113.917 -177.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -73.1 -43.14 62.16 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.175 -2.203 . . . . 0.0 114.302 175.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -88.05 42.6 1.07 Allowed 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 119.887 -1.758 . . . . 0.0 113.308 -177.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 89.0 mt -75.82 -37.27 59.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.622 -1.924 . . . . 0.0 110.779 170.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.55 5.55 20.49 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 123.533 0.733 . . . . 0.0 112.543 173.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 -139.18 71.84 39.75 Favored Pre-proline 0 N--CA 1.43 -1.461 0 O-C-N 120.121 -1.612 . . . . 0.0 111.938 170.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -70.0 -19.7 34.64 Favored 'Trans proline' 0 N--CA 1.433 -2.077 0 CA-C-N 124.024 2.473 . . . . 0.0 115.501 -169.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -70.97 -20.51 62.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 121.446 -0.784 . . . . 0.0 111.818 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -67.34 -44.96 86.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.129 1.772 . . . . 0.0 108.041 176.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -59.16 -40.55 85.91 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 124.843 1.257 . . . . 0.0 112.897 178.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -69.04 -51.58 37.6 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 171.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 25.3 t -65.04 -40.12 94.34 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.506 1.522 . . . . 0.0 113.412 -173.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -48.22 -51.34 25.81 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.699 1.999 . . . . 0.0 114.033 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.401 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -77.85 -33.56 52.18 Favored 'General case' 0 N--CA 1.428 -1.531 0 O-C-N 120.851 -1.156 . . . . 0.0 112.404 -174.073 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.427 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 15.0 mt-10 -47.0 -44.96 20.71 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 170.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 25.6 mt -62.74 -49.85 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 C-N-CA 126.776 2.03 . . . . 0.0 111.325 175.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -73.12 -20.61 60.9 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 118.89 -2.381 . . . . 0.0 114.665 178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.427 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 83.3 m-70 -64.2 -37.43 87.45 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 118.93 -2.356 . . . . 0.0 111.022 171.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.2 m -61.17 -29.44 69.8 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.351 1.461 . . . . 0.0 112.724 173.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -70.56 -57.29 4.9 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.361 -1.462 . . . . 0.0 113.027 168.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.09 -44.44 22.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 116.423 2.009 . . . . 0.0 116.423 -167.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -75.4 -57.85 3.64 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.311 1.444 . . . . 0.0 113.154 -172.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -50.1 -45.27 52.62 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.232 1.813 . . . . 0.0 114.707 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -76.8 -4.88 45.84 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.432 1.493 . . . . 0.0 114.96 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.3 mt -82.17 27.75 0.47 Allowed 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.255 -2.153 . . . . 0.0 115.221 179.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -95.59 41.33 1.1 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.66 -1.9 . . . . 0.0 110.473 170.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.9 t -139.43 132.2 29.09 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 173.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -8.82 -87.75 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 130.082 3.353 . . . . 0.0 119.643 -161.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -141.98 46.27 0.89 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.067 -1.646 . . . . 0.0 111.243 175.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.6 ptt85 -125.52 123.95 25.0 Favored Pre-proline 0 N--CA 1.429 -1.507 0 O-C-N 121.577 -0.955 . . . . 0.0 113.093 -174.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.97 115.24 3.98 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 122.525 2.15 . . . . 0.0 111.225 165.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -158.17 166.7 31.77 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.698 -0.626 . . . . 0.0 109.728 -173.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 85.81 -77.02 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.866 2.866 . . . . 0.0 112.451 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 68.36 -168.9 41.34 Favored Glycine 0 N--CA 1.43 -1.722 0 C-N-CA 124.982 1.277 . . . . 0.0 111.995 -155.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.36 -132.53 0.3 Allowed 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.548 -1.56 . . . . 0.0 108.32 158.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 53.2 m -71.58 112.74 7.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.611 1.165 . . . . 0.0 111.227 172.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -61.62 -30.12 70.49 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.277 -1.515 . . . . 0.0 112.961 173.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -68.68 -23.46 64.39 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.06 -1.65 . . . . 0.0 114.526 169.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -82.87 -36.95 24.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-N 122.11 2.232 . . . . 0.0 110.673 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.35 -36.82 78.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 CA-C-O 122.725 1.25 . . . . 0.0 111.115 178.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -59.01 -57.25 13.91 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.731 2.012 . . . . 0.0 114.351 159.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -47.48 -42.75 23.53 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.876 2.07 . . . . 0.0 115.981 -174.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.33 13.4 mt-10 -71.1 -57.2 4.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.281 -0.887 . . . . 0.0 110.691 176.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.5 t -49.49 -32.77 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 C-N-CA 127.399 2.28 . . . . 0.0 115.029 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.07 71.45 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.542 1.537 . . . . 0.0 112.918 177.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.032 0.92 . . . . 0.0 111.369 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -62.1 -45.27 94.24 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.139 1.776 . . . . 0.0 112.177 170.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -102.92 16.83 25.52 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.913 1.285 . . . . 0.0 110.542 -166.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -62.06 130.38 45.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.456 2.021 . . . . 0.0 116.456 -158.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.49 -27.96 10.99 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.594 -1.316 . . . . 0.0 113.45 -171.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -92.37 80.5 4.93 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 123.592 1.663 . . . . 0.0 111.749 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -69.17 -18.43 63.93 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.647 1.579 . . . . 0.0 113.633 -176.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 80.5 m-20 -48.22 -49.18 33.98 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.045 2.138 . . . . 0.0 112.928 171.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 69.0 mt -70.93 -47.21 60.34 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.007 -1.058 . . . . 0.0 112.23 -177.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.92 -22.93 67.08 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.838 -1.789 . . . . 0.0 114.273 178.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 73.8 m -65.69 -47.2 76.21 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.464 1.505 . . . . 0.0 111.701 174.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -74.59 -26.14 59.72 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 121.001 -1.062 . . . . 0.0 113.55 172.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -59.86 -30.66 69.13 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.818 -1.176 . . . . 0.0 111.972 170.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.95 -19.22 60.91 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 126.305 1.907 . . . . 0.0 115.905 -179.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -73.19 -35.97 66.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.23 1.412 . . . . 0.0 111.434 176.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -85.37 -14.07 47.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.376 1.87 . . . . 0.0 109.863 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 71.5 mt -91.87 170.2 9.81 Favored Pre-proline 0 N--CA 1.43 -1.452 0 C-N-CA 124.595 1.158 . . . . 0.0 111.26 171.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -68.17 153.13 75.4 Favored 'Trans proline' 0 N--CA 1.433 -2.03 0 C-N-CA 122.062 1.841 . . . . 0.0 112.868 166.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -69.84 -40.95 75.52 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.572 1.323 . . . . 0.0 114.572 -174.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.73 -96.73 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 -178.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt -152.66 74.59 1.07 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 169.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 85.3 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 125.995 1.718 . . . . 0.0 112.385 -175.427 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 30.3 m . . . . . 0 CA--C 1.49 -1.349 0 N-CA-C 116.69 2.107 . . . . 0.0 116.69 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . 0.271 42.3 mtp85 76.66 168.59 0.25 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.343 1.857 . . . . 0.0 114.028 173.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.7 ptm -116.51 109.19 16.94 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-O 122.976 1.37 . . . . 0.0 112.341 -174.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.962 1.705 . . . . 0.0 107.019 170.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.298 3.2 mt -61.91 -20.43 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 119.204 -2.185 . . . . 0.0 114.503 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 9.5 tm0? -38.58 -37.82 0.35 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.64 2.776 . . . . 0.0 116.115 164.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 71.4 mmm -66.57 -34.33 77.66 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.176 2.19 . . . . 0.0 115.234 -179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.7 mt -69.99 -33.3 71.86 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.971 -1.705 . . . . 0.0 115.422 -166.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.3 -18.88 57.15 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.668 1.587 . . . . 0.0 111.293 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -82.88 -50.96 8.06 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.579 1.151 . . . . 0.0 110.566 172.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.96 -39.53 85.93 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.196 1.398 . . . . 0.0 113.79 178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.76 -47.94 82.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 173.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -71.92 -31.84 66.76 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.14 -1.6 . . . . 0.0 112.795 -177.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -56.02 -54.5 44.13 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.799 1.639 . . . . 0.0 112.494 165.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.45 -33.16 75.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.235 -1.541 . . . . 0.0 114.718 -179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.91 -40.62 93.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.319 1.847 . . . . 0.0 113.266 170.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 30.6 ttt85 -67.47 -31.8 72.21 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.302 1.841 . . . . 0.0 113.623 173.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 34.1 mtp180 -64.09 -38.32 90.65 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.333 -1.48 . . . . 0.0 113.3 170.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -64.57 -26.48 68.43 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.611 -1.306 . . . . 0.0 114.127 173.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -70.1 -47.19 62.87 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.436 -1.415 . . . . 0.0 112.484 166.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -54.78 -37.53 66.14 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.715 1.606 . . . . 0.0 115.077 179.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -45.59 -19.07 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 129.711 3.205 . . . . 0.0 118.978 177.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.47 -18.54 64.86 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.537 -1.977 . . . . 0.0 115.127 170.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.26 1.605 0 N-CA-C 117.211 2.3 . . . . 0.0 117.211 177.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 2' ' ' SER 0.284 0.6 OUTLIER . . . . . 0 CA--C 1.49 -1.331 0 CA-C-O 119.444 -0.312 . . . . 0.0 110.694 . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.543 ' H ' ' HG2' ' A' ' 1' ' ' GLU . 10.2 m -166.78 143.83 4.8 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.285 -1.509 . . . . 0.0 107.017 166.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.2 p30 -104.84 -82.36 0.52 Allowed 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 124.216 1.006 . . . . 0.0 110.905 173.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.3 m -138.11 36.35 2.33 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 126.473 1.909 . . . . 0.0 108.593 -173.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 ' H ' HG23 ' A' ' 5' ' ' VAL . 28.1 t -48.66 -53.67 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 128.126 2.57 . . . . 0.0 114.224 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -72.62 -24.96 61.13 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 121.042 -1.036 . . . . 0.0 113.654 -176.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -62.23 -43.02 99.77 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.768 -0.582 . . . . 0.0 110.1 168.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.442 ' HA ' HG12 ' A' ' 11' ' ' ILE . 47.8 t30 -76.57 -29.67 56.71 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.509 1.924 . . . . 0.0 111.152 -174.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -63.1 -38.12 89.92 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.539 -1.351 . . . . 0.0 112.348 168.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.76 -38.64 76.84 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 123.807 0.843 . . . . 0.0 112.382 171.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.8 mm -57.97 -50.15 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.75 -1.844 . . . . 0.0 112.255 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 t -58.93 -32.94 70.03 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.804 1.242 . . . . 0.0 113.802 178.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.35 -52.38 54.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.539 -1.351 . . . . 0.0 113.101 171.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 25.8 t -63.9 -34.63 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 125.757 1.623 . . . . 0.0 112.31 178.367 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -58.17 -44.59 88.04 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 165.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -61.17 -43.15 99.34 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.709 -1.87 . . . . 0.0 112.553 174.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.7 mt -57.33 -50.94 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 127.997 2.519 . . . . 0.0 111.864 172.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 70.5 mttt -55.16 -46.96 75.76 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 120.061 -1.649 . . . . 0.0 114.291 171.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.9 m -60.3 -39.78 88.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.839 1.656 . . . . 0.0 114.326 -178.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 51.5 mmt-85 -84.72 -30.39 24.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.39 -2.069 . . . . 0.0 113.964 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -91.92 44.98 1.19 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.727 -1.233 . . . . 0.0 112.873 176.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -75.07 -37.96 61.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.672 -1.892 . . . . 0.0 111.778 171.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -76.47 -10.16 59.19 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.107 0.956 . . . . 0.0 111.759 172.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -128.12 71.53 79.2 Favored Pre-proline 0 N--CA 1.431 -1.418 0 O-C-N 119.712 -1.868 . . . . 0.0 111.447 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.28 4.47 5.85 Favored 'Trans proline' 0 N--CA 1.434 -2.017 0 CA-C-N 124.486 2.638 . . . . 0.0 113.39 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -82.27 -27.95 32.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.056 2.543 . . . . 0.0 112.808 -178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.0 mm -63.19 -34.1 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 124.638 1.175 . . . . 0.0 112.152 -173.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.37 -19.25 8.39 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.083 2.153 . . . . 0.0 115.837 169.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -77.54 -61.64 1.92 Allowed 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.235 -2.166 . . . . 0.0 110.582 164.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.4 t -73.56 -36.62 65.64 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.713 -1.242 . . . . 0.0 113.752 -161.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.96 -50.75 68.14 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.037 1.335 . . . . 0.0 113.476 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 mt -80.08 -36.82 34.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.557 -1.34 . . . . 0.0 111.699 -176.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.482 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 0.4 OUTLIER -48.27 -36.91 14.97 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.331 1.974 . . . . 0.0 116.331 165.569 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.9 mt -71.05 -45.7 70.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.003 -1.685 . . . . 0.0 112.69 167.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.537 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.0 mt -64.67 -18.94 65.43 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 118.46 -2.65 . . . . 0.0 114.334 175.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 91.7 m-70 -65.48 -24.93 67.27 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 118.894 -2.379 . . . . 0.0 114.813 169.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 47.5 m -56.88 -39.95 75.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 120.883 1.674 . . . . 0.0 111.528 168.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -72.69 -61.04 1.94 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.814 1.645 . . . . 0.0 111.826 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -18.92 60.94 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -165.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -59.39 -42.11 90.95 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.168 -1.582 . . . . 0.0 113.532 172.092 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -68.94 -19.1 64.17 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 -170.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -64.98 -30.54 71.54 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.941 2.496 . . . . 0.0 114.136 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.0 mt -89.57 170.33 10.58 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.271 1.028 . . . . 0.0 111.366 -173.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -82.01 73.81 9.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.618 -1.926 . . . . 0.0 110.335 169.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -81.96 -68.87 0.66 Allowed 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.815 1.646 . . . . 0.0 111.347 -173.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 51.8 tttm -101.79 -56.3 2.31 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.356 -1.465 . . . . 0.0 111.138 -174.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.91 -66.93 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.764 0 O-C-N 121.495 -0.753 . . . . 0.0 112.278 -175.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ptp180 -109.95 158.79 34.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 O-C-N 121.775 -0.838 . . . . 0.0 112.039 -172.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.97 123.61 8.03 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.172 1.915 . . . . 0.0 113.85 173.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -100.2 161.43 13.61 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 158.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 8.1 mtp-105 -76.64 -48.94 17.47 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.526 -1.984 . . . . 0.0 115.703 -166.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 118.77 70.5 0.35 Allowed Glycine 0 N--CA 1.43 -1.723 0 N-CA-C 108.169 -1.972 . . . . 0.0 108.169 -167.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.421 0.0 OUTLIER 17.21 -146.59 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.404 1 C-N-CA 132.807 4.443 . . . . 0.0 120.68 -173.819 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.3 p -95.16 132.09 40.48 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.617 -1.302 . . . . 0.0 109.02 167.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -70.9 -19.08 62.64 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.186 -1.572 . . . . 0.0 112.995 -169.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -68.33 -21.73 64.73 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.135 1.902 . . . . 0.0 116.135 165.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.35 -40.37 23.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 123.254 2.752 . . . . 0.0 110.068 -172.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.265 0.4 OUTLIER -67.2 -33.07 60.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 123.078 1.418 . . . . 0.0 109.597 -174.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.59 -59.24 5.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.67 2.388 . . . . 0.0 114.558 160.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.58 -35.75 54.64 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.076 2.15 . . . . 0.0 115.87 -177.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -73.14 -53.79 10.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.608 1.163 . . . . 0.0 111.786 175.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.514 ' HA ' HD13 ' A' ' 65' ' ' LEU . 79.0 t -55.24 -29.14 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.859 2.064 . . . . 0.0 114.187 175.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.98 -33.05 70.23 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.497 1.919 . . . . 0.0 113.201 179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -75.49 -33.71 60.8 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 121.965 0.888 . . . . 0.0 111.676 179.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.514 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -65.62 -36.96 85.22 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.141 1.776 . . . . 0.0 111.698 -174.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.8 m-30 -102.38 0.11 33.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.477 1.511 . . . . 0.0 111.248 -166.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -51.95 119.18 4.02 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 116.937 2.199 . . . . 0.0 116.937 -159.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.27 -43.34 1.72 Allowed Glycine 0 N--CA 1.431 -1.69 0 O-C-N 120.382 -1.449 . . . . 0.0 109.942 -170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -88.6 69.54 8.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 124.138 1.923 . . . . 0.0 111.695 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -56.54 -34.35 66.98 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 130.165 3.386 . . . . 0.0 114.82 -176.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -63.36 -28.39 69.97 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.857 2.063 . . . . 0.0 112.459 -173.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 80.2 mt -68.1 -44.66 75.69 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.328 -1.482 . . . . 0.0 112.928 174.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 1.1 mp -75.55 -19.86 59.04 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.625 -1.922 . . . . 0.0 112.361 179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 4.2 t -61.05 -46.44 90.68 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.37 1.468 . . . . 0.0 112.823 167.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -70.85 -17.76 62.73 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.834 1.42 . . . . 0.0 114.834 169.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.463 ' CZ ' HD11 ' B' ' 202' ' ' ILE . 0.3 OUTLIER -73.5 -22.8 60.03 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.443 -1.411 . . . . 0.0 111.196 173.332 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -68.52 -17.05 70.34 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 127.709 2.576 . . . . 0.0 116.261 -178.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -67.8 -37.9 82.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.223 -1.751 . . . . 0.0 112.46 -175.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -72.2 -60.65 2.13 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 123.607 0.763 . . . . 0.0 111.208 157.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.9 mt -74.26 116.5 53.33 Favored Pre-proline 0 N--CA 1.43 -1.453 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -159.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -79.04 96.63 1.09 Allowed 'Trans proline' 0 N--CA 1.434 -2.026 0 C-N-CA 122.707 2.271 . . . . 0.0 112.401 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -85.27 -43.6 13.61 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.73 1.382 . . . . 0.0 114.73 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.61 -15.07 0.38 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.848 -1.158 . . . . 0.0 112.777 -170.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 7.4 mptt 61.07 31.98 19.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.283 2.633 . . . . 0.0 112.811 -167.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 91.7 mmt-85 . . . . . 0 C--O 1.261 1.664 0 C-N-CA 126.944 2.098 . . . . 0.0 109.006 -171.042 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 20.1 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 66.0 mtt180 -115.61 -173.66 2.38 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.852 -1.155 . . . . 0.0 110.589 177.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.1 tpt -55.06 75.79 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.347 3.459 . . . . 0.0 115.265 167.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -127.08 -178.29 4.37 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.454 -1.404 . . . . 0.0 111.071 170.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.463 HD11 ' CZ ' ' A' ' 76' ' ' PHE 0.253 1.9 mt -58.28 -31.4 42.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.406 0 N-CA-C 114.703 1.371 . . . . 0.0 114.703 -178.218 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -48.5 -39.86 24.66 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.221 1.808 . . . . 0.0 115.495 174.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 6.6 ttp -73.39 -19.22 61.04 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.483 1.513 . . . . 0.0 114.899 -175.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 29.1 mt -64.61 -32.83 74.66 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.086 -1.634 . . . . 0.0 115.235 179.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.537 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -71.43 -24.69 62.08 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.737 1.215 . . . . 0.0 110.577 179.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -80.85 -50.34 9.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 123.944 0.898 . . . . 0.0 111.292 173.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.21 -41.18 75.19 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.513 1.125 . . . . 0.0 114.016 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.06 -41.01 95.51 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.469 1.655 . . . . 0.0 115.469 176.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -65.55 -49.51 68.61 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.241 1.417 . . . . 0.0 111.523 174.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -49.65 -50.82 41.76 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.449 2.3 . . . . 0.0 113.241 173.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.3 mt -70.55 -19.71 62.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.402 2.001 . . . . 0.0 116.402 -175.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -71.35 -46.87 59.45 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.888 -1.133 . . . . 0.0 110.87 168.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 62.8 mtt85 -69.4 -31.72 70.27 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -179.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -58.77 -40.74 84.81 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.776 1.63 . . . . 0.0 113.539 172.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -68.17 -26.49 65.78 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.854 -1.154 . . . . 0.0 113.719 176.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 15.4 mtm180 -69.62 -26.71 64.57 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.407 -1.433 . . . . 0.0 114.043 177.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -73.87 -30.05 62.43 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.025 -1.672 . . . . 0.0 113.551 172.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -69.48 -15.8 63.34 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.668 1.587 . . . . 0.0 113.876 173.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -70.04 -18.31 63.29 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.854 -1.779 . . . . 0.0 114.746 175.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 19.7 m170 . . . . . 0 C--O 1.261 1.678 0 O-C-N 120.927 -1.108 . . . . 0.0 113.892 -175.674 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 47.3 tp10 . . . . . 0 CA--C 1.49 -1.357 0 N-CA-C 109.987 -0.375 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -152.42 110.13 3.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.943 -1.098 . . . . 0.0 108.636 168.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -101.85 107.65 18.89 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.378 -0.826 . . . . 0.0 111.765 -173.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 65.0 m -144.57 85.38 1.77 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.192 0.997 . . . . 0.0 111.172 -175.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 82.0 t -81.87 -45.34 20.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 127.926 2.49 . . . . 0.0 111.549 177.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -69.56 -19.12 63.69 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.842 -1.161 . . . . 0.0 113.488 -178.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -54.23 -47.48 72.16 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 122.004 -0.435 . . . . 0.0 112.109 163.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.432 ' HA ' HG12 ' A' ' 11' ' ' ILE . 26.7 m120 -75.3 -28.25 59.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.389 1.476 . . . . 0.0 112.069 -175.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -70.92 -33.48 70.56 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.952 -1.093 . . . . 0.0 110.633 172.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.98 -44.86 79.36 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.469 1.108 . . . . 0.0 112.365 168.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.432 HG12 ' HA ' ' A' ' 8' ' ' ASN . 10.6 mm -55.37 -52.39 46.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 O-C-N 120.249 -1.532 . . . . 0.0 112.664 175.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 m -55.94 -37.49 69.06 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.931 1.692 . . . . 0.0 113.457 -177.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -65.49 -53.13 46.86 Favored 'General case' 0 CA--C 1.489 -1.403 0 C-N-CA 125.018 1.327 . . . . 0.0 112.891 174.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.26 -38.87 80.79 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 119.884 -1.76 . . . . 0.0 112.823 176.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -59.85 -42.97 94.81 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.479 -1.388 . . . . 0.0 114.733 170.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 56.7 tttt -56.39 -45.74 80.44 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.082 -1.636 . . . . 0.0 113.109 173.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 37.9 mt -59.39 -52.59 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 128.267 2.627 . . . . 0.0 112.504 171.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -37.44 82.1 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.297 -1.502 . . . . 0.0 113.355 -178.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 87.2 m -72.66 -40.78 66.07 Favored 'General case' 0 N--CA 1.431 -1.396 0 C-N-CA 125.899 1.68 . . . . 0.0 113.782 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -89.21 -27.5 20.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 118.674 -2.516 . . . . 0.0 113.042 -176.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -86.12 50.49 1.99 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.559 -1.338 . . . . 0.0 113.945 168.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.2 mt -83.38 -34.45 25.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.22 -2.175 . . . . 0.0 112.263 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -74.21 -14.39 60.93 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.885 -1.134 . . . . 0.0 112.675 172.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -127.7 70.31 76.9 Favored Pre-proline 0 N--CA 1.431 -1.405 0 C-N-CA 124.425 1.09 . . . . 0.0 112.666 177.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -75.58 -5.27 16.33 Favored 'Trans proline' 0 C--N 1.299 -2.028 0 C-N-CA 122.591 2.194 . . . . 0.0 113.455 -173.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.447 ' HG3' HD13 ' A' ' 27' ' ' ILE . 14.8 pt-20 -71.89 -26.03 62.16 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 119.79 1.177 . . . . 0.0 111.398 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.447 HD13 ' HG3' ' A' ' 26' ' ' GLU . 0.9 OUTLIER -65.6 -39.06 83.86 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 125.293 1.437 . . . . 0.0 110.797 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -54.16 -37.99 65.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.003 1.321 . . . . 0.0 112.89 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.3 tpp85 -79.17 -55.27 5.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.232 1.413 . . . . 0.0 112.736 171.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 27.9 p -72.69 -22.65 60.87 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.768 -1.832 . . . . 0.0 114.52 -165.166 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -51.9 -51.42 56.96 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.305 1.442 . . . . 0.0 113.115 164.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.9 OUTLIER -71.34 -38.28 71.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.79 -1.194 . . . . 0.0 112.417 -177.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.506 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 5.5 mm-40 -54.11 -36.94 63.77 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.437 1.495 . . . . 0.0 114.172 173.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.22 -42.23 84.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 O-C-N 120.418 -1.426 . . . . 0.0 111.349 170.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.588 HD12 HD21 ' B' ' 206' ' ' LEU . 1.0 OUTLIER -70.48 -19.81 62.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 118.359 -2.713 . . . . 0.0 114.529 174.632 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.506 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 71.6 m-70 -60.88 -38.54 86.01 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.043 -2.285 . . . . 0.0 112.148 169.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 36.1 m -51.9 -42.48 62.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.464 1.906 . . . . 0.0 112.884 170.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.05 -58.76 3.98 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 126.643 1.977 . . . . 0.0 111.885 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.26 -15.52 58.69 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 116.463 2.024 . . . . 0.0 116.463 -167.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -40.62 -39.16 1.0 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.788 2.835 . . . . 0.0 117.744 178.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.8 pt-20 -58.5 -27.81 64.81 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.204 2.202 . . . . 0.0 115.703 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 69.49 8.71 6.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.776 2.83 . . . . 0.0 115.379 175.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . 0.251 92.9 mt 73.45 109.75 0.07 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 129.502 3.121 . . . . 0.0 113.338 -173.417 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -127.33 76.16 1.64 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 124.703 1.201 . . . . 0.0 107.832 169.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.356 12.2 t 47.2 -143.54 0.36 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 128.361 2.664 . . . . 0.0 115.082 176.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -128.58 134.78 48.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.677 -1.889 . . . . 0.0 106.229 160.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.28 -86.44 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.084 -1.01 . . . . 0.0 111.584 -177.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -106.54 162.5 19.5 Favored Pre-proline 0 N--CA 1.43 -1.456 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.209 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_exo -65.19 138.69 57.28 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 CA-C-N 123.151 2.161 . . . . 0.0 115.068 177.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 3.4 m-85 -115.98 -164.48 0.96 Allowed 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.241 1.417 . . . . 0.0 108.328 177.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -73.24 -22.95 60.31 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.69 -1.881 . . . . 0.0 115.208 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -71.89 157.72 53.16 Favored Glycine 0 N--CA 1.43 -1.749 0 CA-C-O 123.299 1.499 . . . . 0.0 112.227 175.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.423 ' HB2' ' H ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -120.67 -141.29 0.34 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.517 1.527 . . . . 0.0 110.22 -170.302 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.423 ' H ' ' HB2' ' A' ' 53' ' ' MET . 21.9 p -109.96 146.0 35.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.452 1.501 . . . . 0.0 110.983 -178.644 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.9 pm0 -58.54 -22.34 55.21 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.913 1.685 . . . . 0.0 115.225 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.75 -37.52 79.21 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.433 1.642 . . . . 0.0 115.433 173.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -84.81 -33.06 23.01 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.898 1.808 . . . . 0.0 110.426 -167.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.75 -35.03 63.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-N 114.321 -1.309 . . . . 0.0 110.304 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -60.1 -56.47 21.27 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 126.287 1.835 . . . . 0.0 113.476 161.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.6 -42.83 45.65 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.832 2.053 . . . . 0.0 115.938 -178.443 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.354 24.9 mt-10 -74.12 -48.68 27.92 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.867 -1.146 . . . . 0.0 112.545 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' HD13 ' A' ' 65' ' ' LEU . 71.1 t -53.56 -29.9 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 127.382 2.273 . . . . 0.0 114.43 176.201 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.8 -32.0 73.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.617 1.567 . . . . 0.0 112.507 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -73.68 -36.47 65.31 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.578 1.18 . . . . 0.0 110.779 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 62' ' ' VAL . 9.4 mp -64.57 -38.27 90.43 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.809 1.644 . . . . 0.0 111.597 -176.357 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -97.06 -1.45 45.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.246 1.418 . . . . 0.0 111.888 -166.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.0 131.58 47.72 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 116.225 1.935 . . . . 0.0 116.225 -161.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 111.72 -49.45 0.84 Allowed Glycine 0 N--CA 1.43 -1.744 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 -163.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -93.05 100.26 12.71 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.874 -1.368 . . . . 0.0 110.813 -177.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -79.85 -27.88 40.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.005 -1.059 . . . . 0.0 112.706 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -65.67 -27.3 68.25 Favored 'General case' 0 N--CA 1.429 -1.512 0 C-N-CA 126.618 1.967 . . . . 0.0 114.142 -176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 87.9 mt -71.11 -33.13 69.85 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.708 -1.87 . . . . 0.0 112.591 174.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -74.87 -22.89 58.4 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.841 -1.787 . . . . 0.0 111.117 175.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.6 m -68.39 -39.86 81.56 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.716 1.206 . . . . 0.0 111.923 176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -78.71 -18.54 54.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.742 -1.224 . . . . 0.0 113.767 173.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.404 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.1 OUTLIER -70.22 -29.95 66.91 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 124.09 1.9 . . . . 0.0 110.258 166.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.26 -15.42 37.66 Favored Glycine 0 N--CA 1.43 -1.739 1 C-N-CA 131.0 4.143 . . . . 0.0 116.708 -177.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 39.3 mm-40 -55.11 -40.08 70.06 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.208 -1.76 . . . . 0.0 114.398 172.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -93.29 -38.16 11.66 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 123.844 0.858 . . . . 0.0 110.531 169.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 72.2 mt -93.72 146.29 31.47 Favored Pre-proline 0 N--CA 1.43 -1.455 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -160.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.94 150.6 61.28 Favored 'Trans proline' 0 C--N 1.3 -1.989 0 C-N-CA 122.818 2.345 . . . . 0.0 114.315 -170.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -76.18 -74.55 0.22 Allowed 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.153 1.168 . . . . 0.0 114.153 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -153.67 -54.18 0.11 Allowed 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.674 -1.266 . . . . 0.0 107.942 -175.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 68.69 28.24 5.69 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.748 2.019 . . . . 0.0 113.481 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 C--O 1.26 1.621 0 C-N-CA 126.626 1.97 . . . . 0.0 114.008 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 28.8 m . . . . . 0 CA--C 1.49 -1.347 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 4.1 ptp85 -149.98 78.53 1.35 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.286 1.035 . . . . 0.0 109.484 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 4.0 mmt 64.22 23.37 13.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.995 2.118 . . . . 0.0 115.83 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -54.56 140.88 33.41 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.915 1.686 . . . . 0.0 112.982 177.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.494 HG23 HD13 ' A' ' 35' ' ' LEU 0.262 0.2 OUTLIER -50.43 -28.66 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 N-CA-C 116.705 2.113 . . . . 0.0 116.705 -168.285 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -53.13 -28.35 25.41 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 117.32 2.341 . . . . 0.0 117.32 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 29.0 mtp -63.69 -28.5 69.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.506 -1.372 . . . . 0.0 114.283 175.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.72 -32.41 73.9 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.171 -1.581 . . . . 0.0 113.832 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.588 HD21 HD12 ' A' ' 35' ' ' LEU . 20.1 mt -80.48 -19.87 44.97 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.533 1.133 . . . . 0.0 109.344 -173.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -81.07 -50.72 9.3 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.216 1.006 . . . . 0.0 111.769 168.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -61.51 -38.44 87.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.281 1.433 . . . . 0.0 113.903 -178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.96 -41.69 98.29 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.298 1.439 . . . . 0.0 114.076 174.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.11 -46.65 70.33 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.084 1.353 . . . . 0.0 111.496 177.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -53.86 -47.9 70.55 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.559 1.944 . . . . 0.0 113.765 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.4 mt -72.24 -29.04 63.56 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -64.45 -36.57 84.6 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.713 -1.242 . . . . 0.0 112.403 169.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -79.89 -17.77 52.3 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.472 1.909 . . . . 0.0 114.919 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 18.1 mmm180 -58.25 -28.2 64.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.262 -2.149 . . . . 0.0 114.092 171.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -58.82 -26.56 64.26 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.056 2.143 . . . . 0.0 114.535 175.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.53 -38.48 77.54 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.594 -1.316 . . . . 0.0 113.222 173.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -81.08 -20.46 41.47 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.29 -1.506 . . . . 0.0 112.964 -178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.25 -17.89 22.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.467 1.907 . . . . 0.0 115.417 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -62.07 -18.64 61.33 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.427 2.01 . . . . 0.0 116.427 179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . 0.436 ' OXT' ' CD2' ' B' ' 221' ' ' HIS . 11.2 p-80 . . . . . 0 C--O 1.26 1.627 0 C-N-CA 127.536 2.334 . . . . 0.0 116.704 -171.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 63.1 tt0 . . . . . 0 CA--C 1.49 -1.362 0 CA-C-O 119.86 -0.115 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.3 m -147.32 167.16 25.01 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 161.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -99.4 -90.06 0.31 Allowed 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 121.389 -0.82 . . . . 0.0 110.437 176.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 30.6 m -79.28 89.71 4.94 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.933 1.349 . . . . 0.0 112.242 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.4 t -80.49 -48.22 20.03 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 127.252 2.221 . . . . 0.0 109.578 -175.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -69.55 -19.21 63.69 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.799 -1.188 . . . . 0.0 113.75 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -62.44 -45.36 93.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.93 165.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.491 ' HA ' HG12 ' A' ' 11' ' ' ILE . 3.2 m120 -73.26 -28.53 62.18 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.96 1.704 . . . . 0.0 111.371 -176.13 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -69.37 -32.13 70.98 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.252 -1.53 . . . . 0.0 112.126 172.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.51 74.01 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.873 1.269 . . . . 0.0 112.83 171.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.491 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.1 mm -52.26 -46.57 45.28 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 C-N-CA 125.699 1.6 . . . . 0.0 113.603 176.239 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -53.21 -38.08 62.57 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.596 1.558 . . . . 0.0 114.182 176.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -69.51 -52.89 22.27 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.676 1.19 . . . . 0.0 111.51 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.406 HG23 ' H ' ' A' ' 14' ' ' VAL . 2.9 t -57.93 -41.92 81.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 125.255 1.422 . . . . 0.0 113.197 176.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -55.79 -45.86 78.12 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 115.228 1.566 . . . . 0.0 115.228 169.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.3 tttp -64.29 -37.57 87.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.993 -2.317 . . . . 0.0 113.364 176.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 76.9 mt -65.94 -40.94 88.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.031 2.132 . . . . 0.0 112.087 174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -61.96 -45.39 93.87 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.108 -1.62 . . . . 0.0 111.268 172.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.0 m -64.19 -38.8 92.36 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.561 1.689 . . . . 0.0 115.561 -175.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -85.63 -10.31 55.98 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 119.171 -2.206 . . . . 0.0 115.411 176.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -119.28 40.5 3.32 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.242 -0.911 . . . . 0.0 110.742 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.9 mt -71.86 -41.32 68.2 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.336 -1.478 . . . . 0.0 111.259 174.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -77.0 -6.9 54.46 Favored 'General case' 0 N--CA 1.428 -1.546 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.944 174.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -130.2 61.85 60.9 Favored Pre-proline 0 N--CA 1.429 -1.511 0 O-C-N 120.542 -1.349 . . . . 0.0 110.898 -177.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -78.27 -3.49 13.45 Favored 'Trans proline' 0 N--CA 1.434 -2.019 0 C-N-CA 123.439 2.76 . . . . 0.0 111.634 -170.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.2 pt-20 -70.47 -18.68 62.98 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.391 1.477 . . . . 0.0 112.381 166.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -55.94 12.94 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 168.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 29.3 t80 -48.9 -52.08 26.46 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.032 1.733 . . . . 0.0 114.41 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.76 -46.29 87.8 Favored 'General case' 0 CA--C 1.489 -1.384 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 174.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 m -80.93 -34.01 33.65 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.745 -1.222 . . . . 0.0 113.253 -169.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -45.98 -56.62 5.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.478 2.711 . . . . 0.0 113.582 171.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.5 OUTLIER -72.32 -36.9 69.0 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.743 -1.223 . . . . 0.0 112.215 -175.267 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -51.85 -40.31 60.33 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 115.735 1.754 . . . . 0.0 115.735 173.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 65.1 mt -60.38 -47.69 91.39 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.85 1.66 . . . . 0.0 111.756 169.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.574 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.7 mt -71.07 -21.0 62.3 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 119.262 -2.149 . . . . 0.0 115.059 176.453 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 47.6 m-70 -76.32 -30.99 57.9 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.132 -2.23 . . . . 0.0 111.914 174.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -32.97 29.91 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.06 1.744 . . . . 0.0 113.114 168.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -79.41 -63.07 1.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.636 1.574 . . . . 0.0 113.035 170.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.414 ' HG2' HD23 ' B' ' 206' ' ' LEU . 0.0 OUTLIER -76.13 -19.14 58.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -162.31 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.8 tttm -52.68 -40.04 62.5 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.296 2.238 . . . . 0.0 114.423 177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -72.17 -20.54 61.57 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.846 -1.159 . . . . 0.0 113.847 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -74.29 -19.87 60.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.996 -1.065 . . . . 0.0 112.616 173.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.6 mt -83.79 -65.4 1.01 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.803 1.241 . . . . 0.0 113.225 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -144.74 65.21 1.28 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.318 -1.489 . . . . 0.0 112.636 -174.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.7 t -83.31 127.6 33.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-O 121.485 0.66 . . . . 0.0 111.507 167.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 mtpp -122.52 74.59 1.19 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.071 -1.643 . . . . 0.0 109.131 173.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.67 -76.12 0.11 Allowed Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.64 -1.288 . . . . 0.0 110.809 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptt180 -93.04 117.18 67.43 Favored Pre-proline 0 N--CA 1.43 -1.452 0 O-C-N 121.722 -0.869 . . . . 0.0 110.644 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_endo -79.75 98.11 1.12 Allowed 'Trans proline' 0 N--CA 1.434 -2.007 0 C-N-CA 122.804 2.336 . . . . 0.0 111.274 178.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.61 173.79 6.43 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.955 1.359 . . . . 0.0 112.086 -168.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -138.14 -115.38 0.16 Allowed 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 104.679 -2.341 . . . . 0.0 104.679 168.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.9 162.27 42.68 Favored Glycine 0 N--CA 1.43 -1.763 0 O-C-N 120.415 -1.428 . . . . 0.0 113.273 169.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.73 -116.91 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.133 1.773 . . . . 0.0 108.707 169.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.0 m -86.32 117.88 25.41 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.342 -1.474 . . . . 0.0 110.015 149.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -57.82 -33.24 68.39 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.376 1.47 . . . . 0.0 111.085 167.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -54.12 -27.21 31.76 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 116.936 2.199 . . . . 0.0 116.936 165.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -84.61 -34.05 23.21 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 121.185 1.812 . . . . 0.0 110.007 -173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -67.26 -38.61 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 122.756 1.265 . . . . 0.0 109.958 -178.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.0 t80 -56.51 -53.03 62.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.49 2.316 . . . . 0.0 113.935 162.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.52 -41.98 81.93 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.835 1.654 . . . . 0.0 115.368 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' HD12 ' A' ' 65' ' ' LEU . 7.9 mm-40 -70.17 -46.31 64.91 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.787 -1.196 . . . . 0.0 111.618 -179.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.2 t -54.33 -34.02 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 C-N-CA 126.481 1.913 . . . . 0.0 114.266 173.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.06 -29.54 69.91 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.307 1.843 . . . . 0.0 112.528 -175.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 11.4 m-80 -71.29 -38.61 71.77 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.691 0.758 . . . . 0.0 110.271 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -77.85 -20.66 52.69 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.383 0.611 . . . . 0.0 112.471 -176.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -103.33 2.23 33.8 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.166 0.987 . . . . 0.0 111.016 -175.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.3 ttm-85 -58.43 120.52 8.94 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 116.59 2.07 . . . . 0.0 116.59 -170.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.23 -38.46 1.92 Allowed Glycine 0 N--CA 1.429 -1.769 0 C-N-CA 125.192 1.377 . . . . 0.0 110.799 -171.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 27.5 pt20 -118.63 105.79 11.96 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.778 1.751 . . . . 0.0 113.439 -177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -74.53 -20.56 59.92 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 119.61 -1.931 . . . . 0.0 113.307 -178.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -63.11 -32.11 73.42 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.968 2.507 . . . . 0.0 112.325 -173.027 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 78.7 mt -67.9 -49.9 59.28 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 119.825 -1.797 . . . . 0.0 113.41 172.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.17 -21.7 64.87 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.765 -1.834 . . . . 0.0 113.061 -176.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.1 t -62.2 -52.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.547 1.939 . . . . 0.0 111.683 175.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -75.44 -18.35 59.91 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.112 1.365 . . . . 0.0 113.819 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.409 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -60.87 -22.48 64.31 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.172 1.463 . . . . 0.0 113.343 170.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.08 -19.0 29.34 Favored Glycine 0 N--CA 1.43 -1.727 0 C-N-CA 127.871 2.653 . . . . 0.0 116.5 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -46.61 -40.08 12.32 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.418 1.887 . . . . 0.0 115.937 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -92.04 -53.26 4.33 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.337 1.055 . . . . 0.0 110.587 172.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . 0.313 79.7 mt -65.4 -79.55 0.05 OUTLIER Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 117.127 2.269 . . . . 0.0 117.127 -149.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.82 143.37 33.25 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 CA-C-N 126.345 3.302 . . . . 0.0 113.053 175.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.3 -72.85 0.26 Allowed 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.773 1.229 . . . . 0.0 113.613 -176.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.35 -54.11 0.22 Allowed 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.882 -1.137 . . . . 0.0 108.358 174.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.292 18.5 mmtp 80.46 -19.7 0.42 Allowed 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 129.001 2.92 . . . . 0.0 114.462 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.9 mmm-85 . . . . . 0 C--O 1.26 1.635 0 C-N-CA 128.676 2.791 . . . . 0.0 113.864 -175.955 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 9.6 m . . . . . 0 CA--C 1.491 -1.327 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -74.6 171.31 14.08 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.493 -2.004 . . . . 0.0 112.781 172.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 11.4 ptm -76.21 74.44 3.03 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 123.544 1.64 . . . . 0.0 110.434 167.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 50.3 p-10 -90.26 -177.96 5.26 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.088 1.755 . . . . 0.0 112.391 -167.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.409 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.301 1.6 mt -73.78 -33.68 38.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 O-C-N 119.644 -1.91 . . . . 0.0 111.206 178.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -44.52 -42.52 7.27 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.619 1.568 . . . . 0.0 114.932 169.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 2.0 ttp -66.18 -21.1 66.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 116.531 2.049 . . . . 0.0 116.531 177.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 26.6 mt -63.96 -39.83 95.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.702 -1.874 . . . . 0.0 113.828 171.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 35' ' ' LEU . 1.7 mm? -71.74 -17.52 62.19 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.888 0.875 . . . . 0.0 112.536 176.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -80.62 -50.75 9.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.41 1.084 . . . . 0.0 111.021 170.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.39 -42.3 86.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.646 1.578 . . . . 0.0 114.724 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -65.91 -31.84 73.0 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -71.3 -48.99 47.27 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.3 -1.5 . . . . 0.0 110.626 177.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -49.31 -45.15 44.94 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.735 2.414 . . . . 0.0 114.257 169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.92 -28.74 66.93 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.061 -1.649 . . . . 0.0 114.642 -177.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -69.39 -37.46 77.53 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.566 -1.334 . . . . 0.0 113.371 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -62.51 -36.55 82.93 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.412 -1.43 . . . . 0.0 112.421 172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.17 -36.6 73.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.502 1.921 . . . . 0.0 115.483 174.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -65.89 -44.58 84.86 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 125.67 1.588 . . . . 0.0 112.216 173.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -72.39 -37.7 68.65 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -69.27 -30.1 68.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.175 1.39 . . . . 0.0 114.737 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -51.94 -37.44 52.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 -176.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.27 -49.72 10.4 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 28.3 p-80 . . . . . 0 C--O 1.26 1.657 0 C-N-CA 128.472 2.709 . . . . 0.0 116.563 -173.852 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 . . . . . 0 CA--C 1.489 -1.374 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.5 p -156.14 111.3 2.92 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 121.852 2.115 . . . . 0.0 115.78 165.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -79.68 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.181 1.393 . . . . 0.0 111.643 171.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -93.49 23.58 4.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.999 -1.688 . . . . 0.0 114.033 -168.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 95.1 t -63.11 -48.68 86.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.676 1.99 . . . . 0.0 112.038 -176.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -73.27 -18.53 61.21 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -177.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -59.95 -44.04 94.65 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.982 1.313 . . . . 0.0 110.296 166.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.517 ' HA ' HG12 ' A' ' 11' ' ' ILE . 55.0 m-80 -78.34 -20.59 51.06 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.894 2.478 . . . . 0.0 111.321 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.15 -27.03 53.69 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.499 -2.0 . . . . 0.0 111.725 172.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -65.3 -43.94 89.52 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 121.109 -0.994 . . . . 0.0 111.041 168.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.517 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.2 mm -55.44 -46.73 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 125.47 1.508 . . . . 0.0 113.233 173.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.3 m -53.34 -36.9 61.83 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.187 1.395 . . . . 0.0 114.063 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -69.25 -50.36 47.71 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.149 0.98 . . . . 0.0 111.555 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.8 t -62.99 -40.64 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 O-C-N 120.142 -1.599 . . . . 0.0 113.853 176.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -55.55 -45.76 77.22 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.171 1.388 . . . . 0.0 113.841 169.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 20.6 ttmm -60.53 -45.27 94.45 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.735 1.614 . . . . 0.0 113.729 173.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.7 mt -56.35 -50.02 73.98 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.417 0 C-N-CA 126.757 2.023 . . . . 0.0 112.134 171.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -57.43 -47.83 80.75 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.273 -1.517 . . . . 0.0 113.027 174.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.6 m -60.73 -40.13 91.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.474 1.91 . . . . 0.0 114.588 179.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 62.5 mmt-85 -64.93 -55.73 17.47 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.887 -1.758 . . . . 0.0 111.732 170.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -88.66 40.04 0.95 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.754 -1.216 . . . . 0.0 112.972 -168.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.49 -36.52 65.8 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.085 -1.634 . . . . 0.0 111.081 170.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -76.55 -14.71 59.99 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 124.651 1.181 . . . . 0.0 111.753 172.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -132.35 64.74 72.97 Favored Pre-proline 0 N--CA 1.431 -1.403 0 O-C-N 120.312 -1.492 . . . . 0.0 110.283 -175.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -74.08 -4.04 14.76 Favored 'Trans proline' 0 N--CA 1.433 -2.064 0 C-N-CA 123.311 2.674 . . . . 0.0 113.323 -167.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.512 ' HG3' HD13 ' A' ' 27' ' ' ILE . 13.5 pt-20 -70.39 -26.46 63.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.697 1.599 . . . . 0.0 111.17 173.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.512 HD13 ' HG3' ' A' ' 26' ' ' GLU . 1.0 OUTLIER -67.57 -39.23 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.729 -1.232 . . . . 0.0 109.932 177.286 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -68.47 -20.1 64.59 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.117 -1.615 . . . . 0.0 112.782 179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.3 mmm180 -78.84 -54.65 5.85 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.182 -1.573 . . . . 0.0 111.27 166.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.4 p -76.4 -30.42 57.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.444 -2.035 . . . . 0.0 115.05 -168.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -48.26 -57.32 6.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.59 1.956 . . . . 0.0 114.182 177.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.44 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.82 -33.93 64.36 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.28 1.432 . . . . 0.0 112.409 -172.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.406 ' HA ' ' HD2' ' A' ' 36' ' ' HIS . 19.6 mt-10 -60.46 -27.51 67.59 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.761 1.763 . . . . 0.0 115.761 175.13 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 61' ' ' GLU . 43.3 mt -73.73 -41.78 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 O-C-N 120.537 -1.352 . . . . 0.0 111.715 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.486 ' HB2' HD11 ' B' ' 206' ' ' LEU . 4.4 mt -65.95 -27.26 68.03 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 118.493 -2.629 . . . . 0.0 114.162 174.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 33' ' ' GLU . 84.4 m-70 -61.76 -40.68 96.01 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.153 1.781 . . . . 0.0 113.222 171.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -55.44 -34.8 64.79 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 126.236 1.814 . . . . 0.0 112.441 173.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -79.55 -61.49 1.98 Allowed 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 121.013 -1.054 . . . . 0.0 113.778 171.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 6.2 tm0? -61.99 -25.53 67.69 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.909 2.084 . . . . 0.0 116.134 -165.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.5 ttmt -48.31 -32.49 7.46 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 128.159 2.584 . . . . 0.0 116.325 174.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -25.87 5.7 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.172 2.189 . . . . 0.0 116.526 171.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -73.04 -19.03 61.26 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.593 1.557 . . . . 0.0 113.836 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.3 mt -74.26 161.39 29.96 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.989 -1.694 . . . . 0.0 113.465 176.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 55.1 m80 -84.91 69.75 10.81 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.24 1.416 . . . . 0.0 111.121 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 20.5 m -78.58 150.27 32.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.243 1.817 . . . . 0.0 109.801 178.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -85.18 135.35 33.99 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.033 -1.667 . . . . 0.0 110.964 -176.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.71 -70.49 3.17 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.087 -1.633 . . . . 0.0 114.607 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . 0.298 0.0 OUTLIER 18.24 80.23 0.12 Allowed Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 121.468 3.877 . . . . 0.0 121.468 -176.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -80.21 0.36 10.07 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 C-N-CA 122.275 1.983 . . . . 0.0 114.245 177.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -172.6 160.05 4.56 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.688 2.795 . . . . 0.0 107.729 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.293 10.6 ptp180 -176.48 -42.94 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.028 1.331 . . . . 0.0 113.994 150.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.7 49.11 4.18 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.219 -1.551 . . . . 0.0 115.765 -172.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 15.8 ptt? 37.22 -138.8 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 118.933 2.938 . . . . 0.0 118.933 156.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.0 m -116.22 144.16 44.56 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.136 1.374 . . . . 0.0 109.164 168.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 55' ' ' GLU . 0.6 OUTLIER -62.0 -26.38 68.19 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.036 2.134 . . . . 0.0 111.954 171.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -52.67 -37.39 58.68 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 164.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.94 -34.94 24.35 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.335 -2.103 . . . . 0.0 110.087 -167.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.73 -37.03 79.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 122.324 1.059 . . . . 0.0 110.77 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -56.15 -55.51 32.15 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.609 2.364 . . . . 0.0 114.17 162.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -56.13 -40.92 74.54 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.28 1.832 . . . . 0.0 114.812 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.438 ' HB3' HD13 ' A' ' 34' ' ' ILE . 66.8 mm-40 -70.87 -42.39 70.14 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.64 -1.912 . . . . 0.0 111.824 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 65' ' ' LEU . 50.5 t -54.41 -34.45 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.41 0 C-N-CA 126.869 2.068 . . . . 0.0 114.027 171.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.31 -33.92 74.38 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.197 1.399 . . . . 0.0 112.344 -174.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -68.48 -30.47 69.32 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.611 -0.68 . . . . 0.0 112.42 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.493 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.5 mp -72.4 -34.28 67.78 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.847 1.308 . . . . 0.0 111.248 -173.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 13.4 m-30 -100.35 -13.51 18.76 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 123.99 0.916 . . . . 0.0 111.029 -165.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . 0.266 13.5 ptt180 -34.02 100.81 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 129.697 3.199 . . . . 0.0 119.508 -159.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 127.67 -36.9 2.44 Favored Glycine 0 N--CA 1.43 -1.724 0 C-N-CA 125.567 1.556 . . . . 0.0 109.36 -174.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -88.38 101.04 13.49 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 123.025 1.393 . . . . 0.0 109.932 -178.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -81.85 -38.02 26.08 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 115.533 1.679 . . . . 0.0 115.533 -170.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . 0.26 48.1 p30 -63.87 -30.21 71.32 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -166.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 66.7 mt -55.94 -48.48 75.66 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.605 1.562 . . . . 0.0 114.312 167.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.5 mt -73.01 -30.58 63.88 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.755 -1.841 . . . . 0.0 113.575 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 74.1 m -60.58 -43.83 96.91 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.469 1.508 . . . . 0.0 111.89 171.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -71.55 -22.49 61.75 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.748 1.219 . . . . 0.0 113.473 171.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -68.01 -22.15 65.0 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.922 -1.736 . . . . 0.0 111.562 172.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.21 -15.34 22.28 Favored Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 129.86 3.6 . . . . 0.0 116.473 171.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -42.87 -43.63 4.15 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.62 1.968 . . . . 0.0 115.676 174.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -108.61 -43.74 4.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.938 1.295 . . . . 0.0 111.577 177.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 57.4 mt -75.66 161.54 75.81 Favored Pre-proline 0 N--CA 1.43 -1.446 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -163.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -62.53 130.02 28.54 Favored 'Trans proline' 0 N--CA 1.433 -2.031 0 C-N-CA 122.629 2.219 . . . . 0.0 113.312 171.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -70.05 -69.01 0.38 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -166.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -117.7 -65.36 1.19 Allowed 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 22.9 ttmt -161.56 -69.67 0.06 Allowed 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.825 162.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.26 1.638 0 C-N-CA 125.243 1.417 . . . . 0.0 112.047 -175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.7 m . . . . . 0 CA--C 1.491 -1.314 0 CA-C-O 120.86 0.362 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 60.9 mtt180 -94.73 160.12 14.76 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 124.091 0.957 . . . . 0.0 110.872 -179.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 17.9 ptm -70.29 63.0 0.24 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.694 2.479 . . . . 0.0 117.694 -175.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 2.7 p30 -90.85 -176.8 4.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.487 -2.008 . . . . 0.0 112.675 -178.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.253 13.6 mt -70.22 -20.21 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 O-C-N 120.167 -1.583 . . . . 0.0 112.483 -174.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? -52.35 -32.94 40.72 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.555 -1.966 . . . . 0.0 114.694 170.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 33.5 mtt -65.44 -24.41 67.18 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 175.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.5 -37.04 71.3 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.783 -1.823 . . . . 0.0 115.342 -167.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -74.42 -18.58 60.63 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.657 1.583 . . . . 0.0 110.721 179.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -83.28 -48.47 10.41 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.814 1.646 . . . . 0.0 111.03 174.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.21 94.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.505 1.922 . . . . 0.0 113.128 178.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.56 -36.11 79.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 175.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -69.5 -45.02 69.89 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.723 1.609 . . . . 0.0 111.605 178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -56.5 -48.87 76.25 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.695 2.398 . . . . 0.0 113.575 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.71 -33.26 75.25 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -175.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.64 -31.84 73.09 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.589 -1.319 . . . . 0.0 114.289 174.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -72.52 -33.43 66.88 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.831 -1.168 . . . . 0.0 112.839 172.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -60.87 -24.25 65.8 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.294 1.837 . . . . 0.0 114.783 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -55.69 -44.68 77.59 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.692 1.597 . . . . 0.0 113.961 169.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.9 mmt180 -67.88 -20.34 65.11 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.245 -1.534 . . . . 0.0 114.216 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -77.34 -24.78 50.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.61 -1.306 . . . . 0.0 112.771 175.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -77.81 -30.31 51.13 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.941 -1.099 . . . . 0.0 111.614 167.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -71.6 -50.04 34.65 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.64 -1.287 . . . . 0.0 112.357 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.254 68.1 m80 . . . . . 0 C--O 1.259 1.579 0 C-N-CA 127.072 2.149 . . . . 0.0 112.705 -175.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 . . . . . 0 CA--C 1.491 -1.292 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.25 70.0 m 75.27 168.7 0.28 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.166 2.186 . . . . 0.0 112.685 179.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -149.61 -91.87 0.07 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.555 -1.341 . . . . 0.0 109.491 177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 m -112.67 26.55 10.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.162 -1.586 . . . . 0.0 112.931 -175.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 96.0 t -64.78 -56.54 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 127.072 2.149 . . . . 0.0 110.831 -176.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -81.78 -17.29 48.17 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.05 -1.032 . . . . 0.0 112.966 -172.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -56.99 -49.51 75.53 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.927 0.891 . . . . 0.0 111.51 158.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.448 ' HA ' HG12 ' A' ' 11' ' ' ILE . 7.6 m-80 -72.24 -24.96 61.45 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.48 -1.388 . . . . 0.0 112.324 -178.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -75.77 -26.13 57.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.348 -0.845 . . . . 0.0 112.406 171.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.63 -42.65 74.01 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.708 -1.245 . . . . 0.0 111.955 164.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.9 mm -58.84 -53.45 47.41 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.358 -1.464 . . . . 0.0 113.026 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.4 p -53.63 -36.26 61.86 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.182 1.393 . . . . 0.0 113.813 -179.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -62.77 -57.45 10.9 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.168 1.387 . . . . 0.0 112.983 175.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.5 -31.95 55.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.688 1.595 . . . . 0.0 111.794 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -58.43 -49.22 78.09 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 166.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -65.2 -28.48 69.41 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.262 -1.524 . . . . 0.0 114.138 176.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.1 mt -64.05 -52.1 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 126.849 2.06 . . . . 0.0 111.506 168.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 43.9 mttm -54.96 -46.38 75.02 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.719 1.208 . . . . 0.0 113.944 174.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 81.2 m -62.12 -38.71 89.95 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.314 1.846 . . . . 0.0 114.453 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 72.8 mtt85 -79.08 -39.91 32.56 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.3 -2.125 . . . . 0.0 113.821 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 25.7 m-85 -91.02 50.93 1.86 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.204 -1.56 . . . . 0.0 112.263 -179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 86.6 mt -76.97 -37.06 55.95 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.617 -1.302 . . . . 0.0 110.611 167.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.73 -6.56 57.49 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.591 -0.693 . . . . 0.0 112.003 175.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -138.27 70.51 47.34 Favored Pre-proline 0 N--CA 1.431 -1.416 0 CA-C-O 117.229 -1.367 . . . . 0.0 113.067 -178.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -72.39 -1.99 11.04 Favored 'Trans proline' 0 C--N 1.3 -1.994 0 CA-C-N 125.435 2.977 . . . . 0.0 114.589 -178.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -70.28 -35.35 73.67 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.419 2.287 . . . . 0.0 110.816 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.439 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -58.42 -42.6 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 126.235 1.814 . . . . 0.0 109.929 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 6.7 t80 -58.84 -21.14 56.11 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.759 1.623 . . . . 0.0 114.256 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -80.44 -60.32 2.36 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.643 -1.911 . . . . 0.0 110.742 171.069 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -77.64 -19.92 54.65 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -167.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -55.53 -61.01 2.63 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.525 1.53 . . . . 0.0 112.899 167.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.7 mt -65.49 -41.04 93.71 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.957 0.903 . . . . 0.0 112.171 -175.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -46.27 -40.83 12.21 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 116.74 2.126 . . . . 0.0 116.74 175.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 8.7 mt -70.91 -43.61 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 125.194 1.398 . . . . 0.0 111.731 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.681 HD13 HG23 ' B' ' 202' ' ' ILE . 2.0 mt -61.44 -36.64 80.93 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.401 -2.062 . . . . 0.0 113.264 173.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -61.08 -26.4 67.62 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 128.805 2.842 . . . . 0.0 113.603 177.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.85 -35.05 79.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 127.107 2.163 . . . . 0.0 111.638 173.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.421 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.0 OUTLIER -79.8 -52.97 7.24 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.003 1.321 . . . . 0.0 111.231 171.417 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -19.29 64.25 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.56 1.544 . . . . 0.0 114.407 -162.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -40.45 -45.26 2.18 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 129.492 3.117 . . . . 0.0 117.235 175.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.9 -31.35 71.64 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 -81.31 -8.33 59.72 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.988 1.315 . . . . 0.0 112.697 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.7 mt -77.16 -55.28 5.57 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.667 -1.271 . . . . 0.0 109.914 166.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.73 -47.18 55.55 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -176.061 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.348 29.2 p 67.37 -137.63 0.12 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.536 1.934 . . . . 0.0 114.922 179.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt 42.45 50.66 4.76 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 129.392 3.077 . . . . 0.0 117.272 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.14 50.34 0.83 Allowed Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.898 1.237 . . . . 0.0 112.679 177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.4 ptt85 -72.33 114.5 30.18 Favored Pre-proline 0 N--CA 1.43 -1.43 0 O-C-N 121.858 -0.789 . . . . 0.0 111.877 174.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -90.45 -2.66 5.21 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 122.761 2.022 . . . . 0.0 114.097 -159.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -151.06 -161.15 1.28 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.547 1.539 . . . . 0.0 107.367 -177.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 32.0 ptt85 -129.07 72.74 1.48 Allowed 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 123.25 1.5 . . . . 0.0 110.487 170.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.4 -96.39 0.28 Allowed Glycine 0 N--CA 1.43 -1.715 0 C-N-CA 125.98 1.752 . . . . 0.0 112.341 -172.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.421 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -153.59 -153.61 0.48 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.103 1.361 . . . . 0.0 109.621 -171.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 38.6 m -78.42 131.74 37.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 119.77 -1.831 . . . . 0.0 112.644 -177.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -58.18 -30.66 66.6 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.362 2.265 . . . . 0.0 112.894 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -65.12 -25.7 67.88 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.297 1.592 . . . . 0.0 115.297 173.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.44 -37.9 20.84 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-N 120.853 1.661 . . . . 0.0 111.557 -174.251 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -70.16 -33.01 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.493 1.615 . . . . 0.0 110.57 -175.057 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -57.36 -56.53 20.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.025 2.53 . . . . 0.0 113.099 159.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.265 0.4 OUTLIER -54.87 -46.22 74.71 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 116.825 2.157 . . . . 0.0 116.825 -177.56 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.286 32.3 mt-10 -76.71 -19.56 57.55 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.592 -1.318 . . . . 0.0 114.343 -178.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 23.3 t -73.01 -32.85 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 125.218 1.407 . . . . 0.0 113.085 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -26.6 64.73 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.545 1.138 . . . . 0.0 111.061 -166.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -69.93 -29.23 66.34 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 121.51 -0.744 . . . . 0.0 112.092 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.458 ' N ' HD12 ' A' ' 65' ' ' LEU . 3.4 mp -80.99 -27.38 35.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 CA-C-O 123.068 1.413 . . . . 0.0 110.997 -178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -100.4 -4.18 29.53 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.105 1.762 . . . . 0.0 112.099 -166.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.4 ttt180 -58.85 128.2 36.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 117.36 2.355 . . . . 0.0 117.36 -159.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 104.58 -32.82 7.11 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 124.919 1.247 . . . . 0.0 112.929 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -89.97 83.19 6.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-O 123.65 1.69 . . . . 0.0 111.966 -174.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -65.64 -23.57 66.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.57 1.948 . . . . 0.0 115.686 -173.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -54.56 -45.43 73.47 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.213 1.405 . . . . 0.0 111.881 177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 68.7 mt -73.96 -41.92 61.27 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.81 -23.59 63.34 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 118.837 -2.414 . . . . 0.0 113.271 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.3 m -64.74 -48.02 76.1 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.127 1.371 . . . . 0.0 111.414 174.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -74.3 -22.48 59.26 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 176.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -62.44 -30.11 70.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.147 1.379 . . . . 0.0 112.173 172.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -72.48 -18.53 78.46 Favored Glycine 0 N--CA 1.43 -1.743 0 C-N-CA 124.934 1.254 . . . . 0.0 115.004 -176.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -81.55 -21.98 38.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.623 -1.516 . . . . 0.0 112.95 -178.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -72.76 -30.81 64.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.086 1.354 . . . . 0.0 110.327 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 95.6 mt -88.15 162.52 40.24 Favored Pre-proline 0 N--CA 1.43 -1.433 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 -172.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -75.31 125.63 9.24 Favored 'Trans proline' 0 C--N 1.299 -2.033 0 C-N-CA 122.399 2.066 . . . . 0.0 113.84 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -108.69 -42.28 4.56 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 123.361 0.664 . . . . 0.0 110.957 162.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -158.87 -106.92 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 106.101 -1.814 . . . . 0.0 106.101 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm -131.29 36.63 3.79 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.248 -0.908 . . . . 0.0 110.112 157.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 . . . . . 0 C--O 1.261 1.673 0 O-C-N 120.301 -1.499 . . . . 0.0 109.833 173.806 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 21.8 t . . . . . 0 CA--C 1.491 -1.317 0 CA-C-O 119.112 -0.471 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 81.0 mtm180 -107.77 -153.94 0.51 Allowed 'General case' 0 N--CA 1.43 -1.463 0 CA-C-N 120.464 1.484 . . . . 0.0 108.352 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 45.1 mtp -84.7 -110.07 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.797 -1.19 . . . . 0.0 110.351 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 75.63 162.7 0.25 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.084 1.754 . . . . 0.0 112.473 -175.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 35' ' ' LEU . 6.3 mm -64.16 -24.78 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.507 0 O-C-N 119.37 -2.081 . . . . 0.0 113.06 -174.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -34.78 62.04 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.44 -2.037 . . . . 0.0 116.123 175.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 54.9 mmm -61.79 -28.2 69.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.461 1.504 . . . . 0.0 114.346 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 69.2 mt -63.91 -35.82 81.93 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 35' ' ' LEU . 13.3 mt -82.86 -16.72 46.54 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 121.578 0.704 . . . . 0.0 111.003 -173.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -81.74 -54.33 5.47 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 124.458 1.103 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.23 -38.73 71.47 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.682 1.593 . . . . 0.0 114.16 177.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.18 93.88 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 115.554 1.687 . . . . 0.0 115.554 176.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -71.01 -45.84 63.25 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.289 1.042 . . . . 0.0 110.226 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -52.19 -49.98 62.79 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.391 2.276 . . . . 0.0 113.435 169.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 2.8 mt -69.43 -32.17 70.97 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.592 -1.943 . . . . 0.0 115.472 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -62.23 -39.03 91.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.6 -1.312 . . . . 0.0 111.869 165.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 9.9 ttt180 -64.64 -19.41 65.68 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 115.419 1.637 . . . . 0.0 115.419 173.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -71.96 -25.15 61.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.205 -2.185 . . . . 0.0 113.146 175.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.3 -27.56 53.02 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.206 1.002 . . . . 0.0 112.465 175.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.34 -28.88 69.01 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.967 1.307 . . . . 0.0 113.357 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.48 -27.37 66.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.966 2.106 . . . . 0.0 115.651 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -76.79 -27.18 55.15 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.088 -1.632 . . . . 0.0 112.774 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -70.19 -56.21 7.4 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 124.371 1.068 . . . . 0.0 113.099 -169.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.297 74.5 m80 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 127.4 2.28 . . . . 0.0 113.146 -176.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.33 49.0 m 85.37 117.73 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 129.36 3.064 . . . . 0.0 114.052 -176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -77.67 -74.05 0.28 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.997 1.719 . . . . 0.0 111.735 -178.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.6 p -151.15 92.16 1.77 Allowed 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.152 1.381 . . . . 0.0 109.567 -174.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.0 t -75.72 -43.31 40.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 126.557 1.943 . . . . 0.0 108.125 -178.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -69.41 -19.48 63.81 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.643 1.349 . . . . 0.0 114.643 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -64.33 -43.08 95.76 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.365 166.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.434 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.7 t-20 -75.03 -32.44 61.59 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.289 2.236 . . . . 0.0 110.461 -175.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -64.49 -37.2 86.7 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.29 -1.506 . . . . 0.0 112.109 170.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.69 -31.06 70.75 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.977 -1.077 . . . . 0.0 113.553 170.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 8' ' ' ASN . 14.3 mm -66.6 -46.77 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 O-C-N 120.132 -1.605 . . . . 0.0 112.426 171.053 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -52.72 -35.93 56.68 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.968 2.507 . . . . 0.0 114.003 -175.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -71.57 -51.56 22.78 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.008 0.923 . . . . 0.0 112.11 178.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.3 t -63.68 -36.83 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 125.958 1.703 . . . . 0.0 111.945 178.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.91 -46.95 84.2 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 115.329 1.603 . . . . 0.0 115.329 166.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 33.6 ttpt -63.59 -39.55 94.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 119.277 -2.139 . . . . 0.0 112.817 175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 36.3 mt -55.67 -50.92 64.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 126.358 1.863 . . . . 0.0 112.761 170.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -53.89 -46.99 71.56 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.749 1.22 . . . . 0.0 113.106 171.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.7 m -58.88 -43.05 90.84 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -84.59 -15.73 44.59 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.566 -1.959 . . . . 0.0 114.08 175.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-30 -107.09 51.61 0.74 Allowed 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.932 -1.105 . . . . 0.0 112.215 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 78.1 mt -80.9 -35.99 31.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.352 -1.467 . . . . 0.0 109.88 167.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.44 -25.63 68.09 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.469 1.508 . . . . 0.0 112.812 170.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 83.1 m-70 -126.34 79.88 69.79 Favored Pre-proline 0 N--CA 1.431 -1.413 0 O-C-N 120.502 -1.374 . . . . 0.0 111.732 -174.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -74.54 -13.55 22.49 Favored 'Trans proline' 0 C--N 1.299 -2.034 0 CA-C-N 125.173 2.883 . . . . 0.0 113.961 -175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -80.4 -21.32 42.37 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 126.006 1.722 . . . . 0.0 113.255 -165.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.32 -29.65 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.943 2.097 . . . . 0.0 111.739 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.58 -18.34 29.13 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 126.458 1.903 . . . . 0.0 114.719 172.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -80.65 -61.31 2.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.446 -2.034 . . . . 0.0 111.758 168.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.3 p -81.68 -22.69 37.3 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.381 1.622 . . . . 0.0 115.381 -164.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -63.26 -58.84 5.83 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.739 1.215 . . . . 0.0 114.028 173.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.7 mt -66.32 -37.79 86.19 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.359 -1.463 . . . . 0.0 112.69 -171.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -49.0 -28.21 3.74 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 116.803 2.149 . . . . 0.0 116.803 170.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 50.3 mt -72.11 -46.54 58.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 O-C-N 119.976 -1.702 . . . . 0.0 111.385 172.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.651 HD13 HG23 ' B' ' 202' ' ' ILE . 1.2 mt -60.97 -37.64 83.15 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.518 -1.989 . . . . 0.0 112.623 172.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -66.83 -19.16 65.69 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.649 1.98 . . . . 0.0 113.856 176.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -35.4 80.61 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.212 1.405 . . . . 0.0 111.288 170.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -60.66 2.27 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 121.198 -0.939 . . . . 0.0 111.334 169.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -21.89 65.82 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -158.642 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.6 ttmt -44.61 -47.39 10.4 Favored 'General case' 0 N--CA 1.428 -1.53 0 C-N-CA 129.396 3.078 . . . . 0.0 116.648 166.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -64.34 -26.2 68.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.63 1.572 . . . . 0.0 114.47 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -77.33 -32.71 55.39 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.101 -1.625 . . . . 0.0 112.607 175.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 81.1 mt -84.55 -50.05 8.05 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.021 -1.05 . . . . 0.0 112.088 -179.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.7 m170 -114.2 73.66 0.83 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.829 1.652 . . . . 0.0 108.353 -177.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 m -77.03 122.49 25.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.694 1.198 . . . . 0.0 114.014 -169.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.4 tptp -91.36 69.66 5.98 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.219 1.485 . . . . 0.0 113.376 -167.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 81.67 -66.21 3.88 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.111 -1.618 . . . . 0.0 114.41 177.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 20.9 ptt180 -80.39 141.64 53.35 Favored Pre-proline 0 N--CA 1.43 -1.427 0 O-C-N 120.986 -1.302 . . . . 0.0 111.452 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -75.88 100.96 1.43 Allowed 'Trans proline' 0 C--N 1.3 -2.019 0 CA-C-N 123.108 2.146 . . . . 0.0 111.996 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -125.21 154.68 41.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.317 1.447 . . . . 0.0 108.782 -172.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 71.7 mtt180 -113.29 -79.38 0.58 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.157 0.983 . . . . 0.0 110.23 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -143.29 169.71 25.73 Favored Glycine 0 N--CA 1.43 -1.713 0 CA-C-O 123.675 1.708 . . . . 0.0 112.934 -172.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.03 -143.48 0.11 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.822 2.449 . . . . 0.0 111.19 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 18.6 m -72.3 123.73 23.61 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 119.959 -1.713 . . . . 0.0 110.826 167.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -65.75 -32.5 74.08 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.588 1.955 . . . . 0.0 109.847 176.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -59.29 -27.15 65.57 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.748 1.619 . . . . 0.0 114.954 168.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -82.93 -38.61 22.57 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.65 -1.906 . . . . 0.0 109.73 -174.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.251 0.3 OUTLIER -63.14 -43.02 98.66 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.608 1.194 . . . . 0.0 108.703 -177.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 41.3 t80 -54.31 -55.57 27.06 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.613 2.365 . . . . 0.0 114.068 165.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.76 -46.03 59.2 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 126.434 1.893 . . . . 0.0 115.124 178.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.255 35.3 mt-10 -76.94 -24.48 52.38 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.265 -1.522 . . . . 0.0 113.869 -175.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.594 ' HA ' HD23 ' A' ' 65' ' ' LEU . 54.7 t -71.33 -27.04 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 C-N-CA 125.811 1.644 . . . . 0.0 112.651 173.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.92 -31.9 73.24 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.351 -1.468 . . . . 0.0 111.453 -176.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 62.8 m-20 -66.18 -33.08 74.96 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.594 HD23 ' HA ' ' A' ' 62' ' ' VAL . 1.3 mm? -67.38 -40.7 85.74 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 125.636 1.575 . . . . 0.0 109.847 -173.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.8 m-30 -104.74 -0.12 27.69 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.634 1.974 . . . . 0.0 111.137 -163.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -45.87 120.05 2.5 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 127.989 2.515 . . . . 0.0 116.783 -162.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.57 -44.2 1.5 Allowed Glycine 0 N--CA 1.43 -1.736 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.004 -163.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -86.83 93.19 9.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.359 1.076 . . . . 0.0 113.602 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -76.76 -30.42 56.53 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.179 1.392 . . . . 0.0 112.95 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -54.37 -40.2 67.9 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.238 2.215 . . . . 0.0 112.354 -178.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 mt -64.91 -45.08 87.4 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.738 1.385 . . . . 0.0 114.738 175.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -71.75 -24.32 61.75 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.438 -2.039 . . . . 0.0 112.28 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 9.2 t -65.65 -52.86 48.4 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 126.036 1.734 . . . . 0.0 112.189 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -72.24 -19.35 61.72 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.423 -1.423 . . . . 0.0 114.13 173.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.08 -20.35 65.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 124.268 1.027 . . . . 0.0 113.059 174.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -58.79 -20.36 47.36 Favored Glycine 0 N--CA 1.429 -1.787 0 C-N-CA 125.917 1.722 . . . . 0.0 114.82 172.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -67.54 -20.8 65.46 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.383 -1.657 . . . . 0.0 115.448 172.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -90.92 -13.34 33.72 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 123.989 0.916 . . . . 0.0 110.131 177.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 76.5 mt -120.95 93.93 48.89 Favored Pre-proline 0 N--CA 1.431 -1.388 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -63.36 108.01 0.77 Allowed 'Trans proline' 0 C--N 1.299 -2.048 0 C-N-CA 123.977 3.118 . . . . 0.0 112.658 168.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.41 -56.54 6.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.224 1.564 . . . . 0.0 115.224 -169.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . 0.407 ' H ' ' H ' ' A' ' 84' ' ' LYS . . . -161.31 -19.56 0.05 OUTLIER 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -172.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 83' ' ' ALA 0.259 74.6 tttt 77.45 66.74 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 128.307 2.643 . . . . 0.0 111.974 -169.78 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 . . . . . 0 C--O 1.261 1.662 0 C-N-CA 126.526 1.931 . . . . 0.0 109.619 175.757 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 27.1 m . . . . . 0 CA--C 1.491 -1.319 0 CA-C-O 121.061 0.457 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -127.08 131.53 50.86 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.779 -1.201 . . . . 0.0 109.375 178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 29.5 mtp -75.52 93.46 3.0 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.221 -0.924 . . . . 0.0 111.208 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -131.2 173.06 11.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 171.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.651 HG23 HD13 ' A' ' 35' ' ' LEU . 18.1 mm -54.52 -33.8 27.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 C-N-CA 127.699 2.399 . . . . 0.0 112.619 173.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -49.62 -43.9 46.97 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.97 2.508 . . . . 0.0 115.858 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.1 ttp -71.56 -26.71 62.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 -175.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.1 mp -54.72 -31.51 58.29 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.145 1.906 . . . . 0.0 116.145 173.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.438 HD21 HD12 ' A' ' 35' ' ' LEU . 17.2 mt -81.83 -17.64 46.74 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 121.552 0.691 . . . . 0.0 109.196 -171.284 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -82.77 -51.46 7.65 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.035 1.334 . . . . 0.0 110.551 168.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -55.19 -44.59 75.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.742 1.617 . . . . 0.0 114.98 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -58.89 -38.41 78.79 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 173.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -80.66 -31.08 36.5 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.213 1.405 . . . . 0.0 111.904 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 8.8 t80 -61.93 -44.86 95.9 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.954 2.102 . . . . 0.0 111.908 167.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.88 -30.87 71.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -178.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -54.31 -41.81 69.42 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.46 1.504 . . . . 0.0 113.733 167.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -73.59 -22.48 60.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 83.6 mtt180 -64.42 -47.41 79.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 119.605 -1.934 . . . . 0.0 112.081 177.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.2 mt-10 -67.2 -38.83 85.98 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.384 1.073 . . . . 0.0 112.634 -179.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 24.3 mtm180 -72.49 -23.53 61.04 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 114.752 1.39 . . . . 0.0 114.752 176.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -74.05 -45.0 52.27 Favored 'General case' 0 N--CA 1.429 -1.514 0 O-C-N 120.182 -1.574 . . . . 0.0 112.662 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -54.83 -29.38 54.76 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.722 2.009 . . . . 0.0 115.574 -175.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -53.97 -43.7 70.13 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.611 2.364 . . . . 0.0 114.472 172.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 128.087 2.555 . . . . 0.0 115.898 -173.842 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 . . . . . 0 CA--C 1.489 -1.368 0 CA-C-O 121.005 0.431 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.285 72.4 m 78.52 118.46 0.06 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.878 2.471 . . . . 0.0 115.208 170.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -87.43 -17.1 33.0 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.655 1.582 . . . . 0.0 111.179 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.0 m -76.7 82.03 3.33 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.247 2.219 . . . . 0.0 114.278 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 65.9 t -81.34 -59.37 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.041 2.136 . . . . 0.0 110.384 177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.25 -20.3 57.52 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.937 -1.102 . . . . 0.0 112.548 -169.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.7 -42.91 98.13 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.133 165.095 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.456 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.2 t-20 -73.6 -27.82 61.49 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.914 1.686 . . . . 0.0 110.82 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -69.45 -31.91 70.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.496 -1.378 . . . . 0.0 112.159 171.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.99 -46.85 73.32 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 123.879 0.872 . . . . 0.0 111.5 169.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 8' ' ' ASN . 11.0 mm -55.11 -47.3 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.542 1.537 . . . . 0.0 112.57 174.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.9 m -60.95 -19.79 61.36 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 126.057 1.743 . . . . 0.0 113.999 177.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -80.24 -58.63 3.05 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.268 -1.52 . . . . 0.0 110.958 170.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 1.7 t -59.99 -36.16 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.048 1.339 . . . . 0.0 114.0 179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -63.84 -37.23 86.63 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.879 -1.763 . . . . 0.0 114.944 170.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -66.99 -38.64 86.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.402 -2.061 . . . . 0.0 112.189 173.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 89.3 mt -59.87 -50.58 79.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.111 1.764 . . . . 0.0 111.174 172.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.7 ptmt -61.7 -35.28 77.57 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.352 -1.468 . . . . 0.0 114.611 177.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.7 m -77.48 -38.29 49.45 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.976 1.71 . . . . 0.0 112.947 179.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 18.7 mmt180 -74.98 -41.98 58.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.915 -2.365 . . . . 0.0 112.978 176.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.8 m-85 -88.46 46.07 1.35 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.422 -1.424 . . . . 0.0 113.09 -176.562 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 73.8 mt -78.52 -30.95 47.38 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.392 1.477 . . . . 0.0 110.881 166.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 16.5 t0 -79.01 -11.52 60.01 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.017 1.327 . . . . 0.0 111.688 171.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -142.61 61.46 11.3 Favored Pre-proline 0 N--CA 1.429 -1.476 0 O-C-N 120.071 -1.643 . . . . 0.0 112.971 -177.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.18 4.89 4.43 Favored 'Trans proline' 0 N--CA 1.433 -2.071 0 CA-C-N 124.964 2.808 . . . . 0.0 113.886 -174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -71.76 -20.08 61.93 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 120.197 1.362 . . . . 0.0 112.295 166.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.421 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.9 OUTLIER -66.68 -52.37 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.401 0 C-N-CA 125.004 1.321 . . . . 0.0 109.976 -179.15 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -49.82 -43.88 48.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 127.111 2.164 . . . . 0.0 113.73 -177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 45.6 tpt85 -65.62 -42.52 91.47 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.842 1.657 . . . . 0.0 115.294 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.9 t -84.22 -34.21 23.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.884 -1.135 . . . . 0.0 113.409 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -46.0 -59.96 2.55 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 128.889 2.875 . . . . 0.0 115.545 178.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.87 -34.41 73.54 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.06 -1.65 . . . . 0.0 112.112 -171.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -54.14 -30.01 47.43 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 117.041 2.237 . . . . 0.0 117.041 168.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.496 HG21 ' HB2' ' A' ' 61' ' ' GLU . 70.3 mt -69.02 -42.9 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 120.211 -1.556 . . . . 0.0 110.39 171.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD11 HD22 ' B' ' 205' ' ' LEU . 1.3 mt -70.65 -19.77 62.78 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.477 -2.64 . . . . 0.0 113.323 175.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 91.9 m-70 -68.36 -30.43 69.38 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.648 -2.532 . . . . 0.0 113.357 170.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 55.0 m -58.59 -32.25 68.8 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.094 1.758 . . . . 0.0 112.569 168.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -71.1 -57.11 4.84 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.231 1.412 . . . . 0.0 112.488 172.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.55 -44.4 28.69 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -167.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -60.54 -36.55 78.71 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 127.535 2.334 . . . . 0.0 115.095 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 83.7 mt-10 -71.0 -19.65 62.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.434 1.494 . . . . 0.0 114.895 174.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -94.05 -74.61 0.53 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.392 1.077 . . . . 0.0 110.807 177.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.3 mt -121.0 132.21 54.77 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.91 1.284 . . . . 0.0 109.076 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . 0.266 10.2 p-80 -153.01 -73.79 0.13 Allowed 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.474 -1.391 . . . . 0.0 111.3 173.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.1 t -120.83 -56.15 1.96 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.079 0.952 . . . . 0.0 110.805 178.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -136.3 163.84 29.48 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 125.404 1.482 . . . . 0.0 107.71 -172.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -72.93 83.54 0.6 Allowed Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 125.025 1.298 . . . . 0.0 114.193 175.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -66.19 175.3 1.32 Allowed Pre-proline 0 N--CA 1.429 -1.485 0 C-N-CA 127.474 2.31 . . . . 0.0 113.159 163.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -63.44 123.37 11.97 Favored 'Trans proline' 0 N--CA 1.434 -2.013 0 C-N-CA 122.547 2.165 . . . . 0.0 111.837 164.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 22.7 t80 -74.46 135.57 42.29 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.983 1.313 . . . . 0.0 110.855 -172.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 53.2 mmm-85 -130.81 -114.63 0.24 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 78.21 119.26 0.22 Allowed Glycine 0 N--CA 1.431 -1.69 0 CA-C-O 123.19 1.439 . . . . 0.0 112.531 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.47 -152.6 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 123.22 1.485 . . . . 0.0 113.207 -177.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.4 m -94.44 140.89 29.23 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.324 1.45 . . . . 0.0 111.338 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -37.35 30.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.51 1.524 . . . . 0.0 113.784 170.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.39 -42.16 14.66 Favored 'General case' 0 N--CA 1.431 -1.386 0 C-N-CA 127.5 2.32 . . . . 0.0 116.25 168.128 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.72 -39.07 18.93 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.67 -1.893 . . . . 0.0 111.147 -171.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.74 -37.27 79.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 CA-C-O 122.701 1.238 . . . . 0.0 111.018 -178.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -58.37 -54.38 47.62 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.088 2.155 . . . . 0.0 114.196 162.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -53.77 -40.58 66.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 126.487 1.915 . . . . 0.0 115.54 179.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.496 ' HB2' HG21 ' A' ' 34' ' ' ILE . 24.5 mm-40 -69.19 -54.18 16.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.954 1.302 . . . . 0.0 109.283 178.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 42.8 t -51.79 -36.09 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.358 1.863 . . . . 0.0 114.885 175.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.86 84.13 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 127.246 2.218 . . . . 0.0 111.815 -178.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -72.22 -31.17 65.6 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.222 -0.923 . . . . 0.0 112.443 -179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.477 HD12 ' O ' ' A' ' 61' ' ' GLU . 1.8 mp -76.61 -23.31 53.4 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.267 -0.895 . . . . 0.0 113.276 175.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -103.95 6.92 36.59 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.852 1.261 . . . . 0.0 111.024 -173.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.81 132.14 49.97 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.851 1.426 . . . . 0.0 114.851 -167.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.86 -50.79 0.84 Allowed Glycine 0 N--CA 1.431 -1.7 0 N-CA-C 109.309 -1.516 . . . . 0.0 109.309 -171.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -103.71 104.44 14.47 Favored 'General case' 0 N--CA 1.429 -1.513 0 CA-C-O 122.931 1.348 . . . . 0.0 112.968 -176.376 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -71.65 -22.34 61.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.758 1.623 . . . . 0.0 112.29 177.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -49.11 -43.03 41.06 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 129.488 3.115 . . . . 0.0 113.579 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 75.4 mt -68.71 -52.05 34.99 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 121.094 -1.004 . . . . 0.0 113.236 -179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -67.62 -21.48 65.38 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.899 -1.75 . . . . 0.0 112.671 -176.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 52.4 m -65.36 -49.23 70.15 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.051 1.74 . . . . 0.0 112.109 173.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -69.29 -24.69 63.99 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.893 -1.13 . . . . 0.0 113.591 172.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -61.63 -26.8 68.22 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.787 -1.196 . . . . 0.0 112.42 175.184 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.44 -15.4 38.93 Favored Glycine 0 N--CA 1.43 -1.764 0 C-N-CA 129.571 3.462 . . . . 0.0 117.314 176.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -49.32 -32.19 10.62 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 177.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -109.23 -39.71 5.16 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.609 1.164 . . . . 0.0 111.071 166.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 39.1 mt -83.79 131.75 50.93 Favored Pre-proline 0 N--CA 1.43 -1.426 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -164.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -67.53 118.17 5.39 Favored 'Trans proline' 0 C--N 1.299 -2.049 0 CA-C-N 123.451 2.268 . . . . 0.0 114.622 175.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -75.63 -71.85 0.35 Allowed 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.868 1.267 . . . . 0.0 111.703 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -134.73 -32.98 0.97 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.849 1.26 . . . . 0.0 109.905 -179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.266 9.3 ttpt 78.06 78.51 0.07 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.809 2.444 . . . . 0.0 111.525 175.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 47.8 mtt-85 . . . . . 0 C--O 1.26 1.624 0 C-N-CA 127.24 2.216 . . . . 0.0 111.129 -173.679 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.49 -1.332 0 CA-C-O 121.533 0.683 . . . . 0.0 112.559 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.6 mtp180 -124.56 -177.18 3.73 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 5.3 mmm -83.4 -135.72 0.04 OUTLIER 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.408 -1.433 . . . . 0.0 110.682 168.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 79.36 165.67 0.19 Allowed 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 127.422 2.289 . . . . 0.0 110.945 -176.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.417 HG23 HD13 ' A' ' 35' ' ' LEU 0.267 1.2 mt -62.5 -22.68 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.78 -1.825 . . . . 0.0 115.676 -167.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -51.33 -32.51 25.7 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 116.468 2.025 . . . . 0.0 116.468 168.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 44.1 mmm -58.57 -41.89 86.74 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.39 1.476 . . . . 0.0 113.707 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.447 HD22 HD11 ' A' ' 35' ' ' LEU . 8.3 mp -55.12 -36.48 65.78 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 171.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . . . . . . . . . 21.3 mt -81.89 -19.43 40.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 -171.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -83.33 -47.36 11.56 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-O 122.183 0.992 . . . . 0.0 111.036 170.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -56.62 -42.64 79.16 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.81 2.044 . . . . 0.0 113.806 176.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.4 86.74 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.35 -1.469 . . . . 0.0 114.315 173.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -65.07 -45.12 86.61 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 121.003 -1.061 . . . . 0.0 112.607 173.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -53.47 -46.17 69.85 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.822 1.649 . . . . 0.0 113.862 173.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 8.2 mt -70.94 -30.32 66.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.839 -1.163 . . . . 0.0 113.541 177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -62.1 -40.42 95.81 Favored 'General case' 0 N--CA 1.428 -1.534 0 O-C-N 120.922 -1.111 . . . . 0.0 113.689 167.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 79.2 mtt-85 -66.73 -35.78 80.93 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.469 -1.394 . . . . 0.0 112.968 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -60.36 -28.58 68.3 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 178.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.87 -39.85 90.76 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.897 1.679 . . . . 0.0 113.332 170.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.7 mpt_? -77.23 -41.79 39.85 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.889 1.276 . . . . 0.0 110.992 -178.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.0 -30.63 70.41 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 126.408 1.883 . . . . 0.0 115.194 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -43.85 -31.53 0.87 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 129.326 3.051 . . . . 0.0 118.018 -176.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -56.91 -31.89 65.36 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 37.4 m170 . . . . . 0 C--O 1.26 1.634 0 C-N-CA 125.912 1.685 . . . . 0.0 114.159 -179.908 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 . . . . . 0 CA--C 1.49 -1.351 0 CA-C-O 120.826 0.346 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 17.9 p -159.58 129.51 5.52 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.832 -1.167 . . . . 0.0 110.631 170.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -128.76 104.51 7.67 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.146 -0.972 . . . . 0.0 110.484 176.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 m 50.55 91.4 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 74.2 t -74.03 -52.59 19.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.132 1.773 . . . . 0.0 109.832 -176.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 49.9 mp0 -70.04 -18.75 63.3 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -58.63 -45.46 89.19 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 118.78 0.718 . . . . 0.0 111.716 163.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.469 ' HA ' HG12 ' A' ' 11' ' ' ILE . 52.2 m-80 -76.27 -28.93 57.25 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.93 1.292 . . . . 0.0 112.756 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -70.35 -31.52 68.83 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.179 -1.576 . . . . 0.0 111.7 171.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -46.6 74.94 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.38 1.072 . . . . 0.0 111.81 167.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.3 mm -53.22 -51.09 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 O-C-N 119.941 -1.724 . . . . 0.0 112.48 174.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.9 m -53.61 -35.96 61.48 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 127.14 2.176 . . . . 0.0 113.351 176.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -71.54 -55.75 7.23 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.493 1.517 . . . . 0.0 112.139 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.91 -38.03 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.811 -1.18 . . . . 0.0 112.706 178.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 -55.81 -46.33 78.09 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.09 -1.631 . . . . 0.0 115.038 168.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.4 mtmm -65.35 -36.56 84.4 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.96 -1.712 . . . . 0.0 113.149 176.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 58.1 mt -61.34 -49.81 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.762 1.625 . . . . 0.0 110.758 173.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.42 -35.73 80.15 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 124.788 1.235 . . . . 0.0 113.874 178.276 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.3 m -78.91 -38.14 38.19 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.074 1.35 . . . . 0.0 113.229 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 35.8 mmt180 -78.7 -41.18 31.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.765 -2.459 . . . . 0.0 113.636 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -88.84 44.87 1.24 Allowed 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.488 -1.382 . . . . 0.0 112.907 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.1 mt -74.48 -31.5 62.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.167 -1.583 . . . . 0.0 111.225 169.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -71.99 -18.78 61.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 121.483 -0.761 . . . . 0.0 111.773 171.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 87.7 m-70 -127.24 67.09 70.27 Favored Pre-proline 0 N--CA 1.43 -1.474 0 O-C-N 120.72 -1.237 . . . . 0.0 111.441 -176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.07 -12.04 27.74 Favored 'Trans proline' 0 C--N 1.299 -2.064 0 C-N-CA 123.932 3.088 . . . . 0.0 114.077 -168.513 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 26.1 pt-20 -70.14 -20.59 63.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 172.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.454 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.3 OUTLIER -64.69 -48.14 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.388 1.475 . . . . 0.0 109.347 178.274 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -48.78 -44.38 38.85 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.176 1.79 . . . . 0.0 114.448 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 49.3 mtt180 -76.43 -47.95 21.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 49.0 m -70.8 -32.75 69.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.641 -1.287 . . . . 0.0 114.375 -174.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -50.44 -56.2 12.53 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.224 1.81 . . . . 0.0 112.926 175.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.405 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 3.9 mt -69.07 -38.84 79.27 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.513 1.125 . . . . 0.0 112.596 -178.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.31 -41.69 51.41 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 171.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 17.3 mt -63.76 -48.98 84.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.423 0 O-C-N 120.239 -1.538 . . . . 0.0 111.776 169.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.621 HD13 HG23 ' B' ' 202' ' ' ILE . 1.8 mt -61.92 -30.28 70.79 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 119.028 -2.295 . . . . 0.0 114.85 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 -68.46 -16.18 63.81 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.06 2.144 . . . . 0.0 114.635 173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.5 m -64.12 -50.95 66.23 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 119.874 -1.767 . . . . 0.0 110.211 163.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 12.6 t80 -64.44 -60.37 3.23 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.95 1.7 . . . . 0.0 113.585 176.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -67.25 -19.59 65.54 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.961 1.704 . . . . 0.0 115.207 -164.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -39.26 -39.84 0.68 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 129.51 3.124 . . . . 0.0 117.413 178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -49.57 -35.79 21.79 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.275 2.63 . . . . 0.0 115.895 169.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 3.8 tp-100 73.93 -1.18 3.14 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 127.269 2.227 . . . . 0.0 116.026 169.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.1 mt 55.51 48.86 17.89 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.958 2.103 . . . . 0.0 114.002 174.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -104.62 -50.43 3.3 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.865 1.266 . . . . 0.0 110.594 -172.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.1 t -92.81 170.34 9.77 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.121 -0.987 . . . . 0.0 110.024 174.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -129.23 134.11 47.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.042 1.337 . . . . 0.0 108.19 177.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 179.84 -90.7 0.08 OUTLIER Glycine 0 N--CA 1.43 -1.751 0 O-C-N 120.361 -1.462 . . . . 0.0 113.278 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -113.74 155.77 44.61 Favored Pre-proline 0 N--CA 1.43 -1.442 0 O-C-N 121.587 -0.949 . . . . 0.0 111.667 -172.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -71.5 114.89 4.08 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 123.451 2.768 . . . . 0.0 112.001 164.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.83 148.14 25.94 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.657 -1.238 . . . . 0.0 107.657 176.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.272 45.5 mtp180 71.75 -45.48 0.62 Allowed 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.057 2.543 . . . . 0.0 116.978 169.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -87.82 20.83 26.2 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 125.397 1.475 . . . . 0.0 114.026 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 49.61 -142.71 0.58 Allowed 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 118.113 2.634 . . . . 0.0 118.113 149.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 83.4 p -107.16 142.69 36.46 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.87 1.319 . . . . 0.0 110.517 166.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.2 mt-10 -70.02 -18.66 63.32 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.157 1.783 . . . . 0.0 111.211 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -59.08 -34.13 71.62 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.892 2.077 . . . . 0.0 116.17 163.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.02 -37.98 21.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 122.113 2.233 . . . . 0.0 109.73 -172.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . 0.267 0.3 OUTLIER -61.74 -40.25 86.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 CA-C-O 122.64 1.21 . . . . 0.0 109.472 177.177 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.58 -51.64 69.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.568 2.347 . . . . 0.0 113.847 167.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -44.5 -45.97 9.51 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 127.448 2.299 . . . . 0.0 115.15 -179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.274 7.1 mt-10 -73.2 -56.26 5.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.093 -1.004 . . . . 0.0 111.55 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 65' ' ' LEU . 93.5 t -47.39 -36.41 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.446 0 C-N-CA 127.66 2.384 . . . . 0.0 115.674 -178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.9 -40.26 92.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.692 1.197 . . . . 0.0 112.556 178.432 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.262 3.8 p30 -74.06 -29.04 61.69 Favored 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 121.146 -0.971 . . . . 0.0 113.324 -177.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.454 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.8 mp -61.72 -42.66 99.25 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 125.67 1.588 . . . . 0.0 112.78 171.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -90.38 -27.46 19.32 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.358 1.063 . . . . 0.0 111.608 -166.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -29.91 110.57 0.06 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 130.835 3.654 . . . . 0.0 118.438 -173.379 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 132.16 -44.13 1.23 Allowed Glycine 0 N--CA 1.43 -1.706 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 -167.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -96.49 101.09 12.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 121.946 0.879 . . . . 0.0 112.624 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -76.34 -32.08 58.48 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 124.75 1.22 . . . . 0.0 113.099 -174.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -62.48 -33.36 74.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.569 1.948 . . . . 0.0 112.389 -175.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.1 mt -68.94 -44.09 73.75 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 114.454 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.27 -20.86 60.0 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.55 -1.969 . . . . 0.0 112.302 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 23.3 t -63.93 -51.5 64.14 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.435 1.494 . . . . 0.0 111.437 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -68.32 -21.11 64.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 172.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -66.59 -23.6 66.21 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.96 -1.713 . . . . 0.0 112.399 173.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -60.27 -15.63 38.68 Favored Glycine 0 N--CA 1.43 -1.761 0 C-N-CA 129.786 3.565 . . . . 0.0 116.287 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -43.57 -42.99 5.36 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.317 2.247 . . . . 0.0 115.619 178.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -106.48 -45.77 4.18 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.871 1.268 . . . . 0.0 110.964 175.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 29.4 mt -75.59 158.45 83.14 Favored Pre-proline 0 N--CA 1.43 -1.464 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -161.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -70.73 106.66 1.88 Allowed 'Trans proline' 0 C--N 1.3 -2.011 0 C-N-CA 122.563 2.175 . . . . 0.0 112.426 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -55.85 23.14 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.863 2.065 . . . . 0.0 113.491 -175.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -147.12 -73.39 0.21 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 103.778 -2.675 . . . . 0.0 103.778 168.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.5 ptpt -165.51 20.33 0.05 OUTLIER 'General case' 0 N--CA 1.429 -1.5 0 N-CA-C 115.654 1.724 . . . . 0.0 115.654 -179.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? . . . . . 0 C--O 1.259 1.599 0 O-C-N 120.383 -1.448 . . . . 0.0 111.137 170.984 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.491 -1.324 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -105.98 -162.08 0.84 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.414 -1.429 . . . . 0.0 110.329 -179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.4 mtt -101.75 151.15 22.39 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.806 -1.184 . . . . 0.0 112.772 -177.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -154.42 -178.2 6.99 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.529 2.732 . . . . 0.0 103.708 166.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.621 HG23 HD13 ' A' ' 35' ' ' LEU . 1.3 mm -66.18 -18.03 23.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 O-C-N 120.154 -1.591 . . . . 0.0 112.247 167.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -48.97 -47.55 43.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 118.254 2.687 . . . . 0.0 118.254 -178.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 1.7 mpp? -62.3 -21.46 65.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 115.371 1.619 . . . . 0.0 115.371 -175.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 89.8 mt -57.28 -40.11 77.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.526 1.676 . . . . 0.0 115.526 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 35' ' ' LEU . 17.6 mt -82.26 -17.6 45.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 121.845 0.831 . . . . 0.0 110.53 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -82.05 -53.8 5.81 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.953 1.701 . . . . 0.0 109.252 176.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.18 -41.37 83.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 127.381 2.273 . . . . 0.0 113.485 176.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.99 -41.12 97.61 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 174.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -67.4 -43.44 81.29 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 119.727 1.149 . . . . 0.0 111.583 179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -52.16 -53.05 47.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.271 1.829 . . . . 0.0 113.224 168.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.3 mt -68.66 -30.45 69.14 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.218 -1.551 . . . . 0.0 114.949 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -60.52 -45.43 93.86 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.469 -1.394 . . . . 0.0 112.619 168.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 37.4 mmm-85 -66.24 -36.2 82.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.644 1.578 . . . . 0.0 113.638 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -58.25 -39.35 78.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.207 1.803 . . . . 0.0 114.198 173.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -61.06 -45.62 94.0 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.693 1.197 . . . . 0.0 113.898 176.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.5 mpt_? -69.52 -37.72 77.27 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.5 1.12 . . . . 0.0 112.345 -178.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.39 -44.93 84.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.4 1.88 . . . . 0.0 112.771 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -65.3 -30.26 71.1 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -76.65 -46.59 25.22 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 124.034 0.934 . . . . 0.0 112.759 173.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.252 10.8 m-70 . . . . . 0 C--O 1.259 1.596 0 C-N-CA 129.068 2.947 . . . . 0.0 112.952 175.56 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 75.1 tt0 . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 119.884 -0.103 . . . . 0.0 110.797 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.9 p -148.28 122.91 9.82 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.394 -1.441 . . . . 0.0 112.77 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -123.97 -60.74 1.42 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.837 -1.164 . . . . 0.0 110.393 169.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 75.8 m -125.58 35.29 4.75 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-O 122.982 1.372 . . . . 0.0 112.612 -163.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.7 t -65.59 -49.76 75.93 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 126.071 1.749 . . . . 0.0 112.633 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -80.24 -18.43 49.47 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.677 -1.264 . . . . 0.0 113.129 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -57.79 -49.75 75.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 121.566 -0.709 . . . . 0.0 111.231 162.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.463 ' HA ' HG12 ' A' ' 11' ' ' ILE . 36.9 m-80 -75.34 -26.82 58.88 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.504 -1.372 . . . . 0.0 112.051 -175.018 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -69.76 -31.14 68.93 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.508 -1.37 . . . . 0.0 112.067 170.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.15 -45.38 81.2 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.953 -1.092 . . . . 0.0 110.998 170.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.463 HG12 ' HA ' ' A' ' 8' ' ' ASN . 9.7 mm -55.37 -48.44 76.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 O-C-N 120.555 -1.34 . . . . 0.0 113.147 173.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -52.72 -42.45 64.87 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 126.141 1.777 . . . . 0.0 113.48 175.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -65.02 -56.04 15.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.185 1.794 . . . . 0.0 112.908 177.068 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.4 t -58.75 -42.47 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 125.252 1.421 . . . . 0.0 112.756 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -57.15 -42.58 81.26 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 172.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -63.47 -41.19 98.59 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.357 -1.464 . . . . 0.0 113.098 172.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.8 mt -60.07 -44.87 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 C-N-CA 125.507 1.523 . . . . 0.0 112.527 174.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 31.5 mtmt -59.45 -52.63 64.78 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.167 -1.583 . . . . 0.0 112.891 171.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.0 m -66.35 -37.27 84.94 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.816 1.646 . . . . 0.0 113.928 -174.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -84.42 -34.96 23.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 118.883 -2.386 . . . . 0.0 113.434 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -90.83 45.3 1.24 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.56 -1.337 . . . . 0.0 112.29 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 93.6 mt -75.96 -36.33 59.33 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.482 -2.011 . . . . 0.0 111.263 169.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -67.64 -18.16 64.86 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.121 0.968 . . . . 0.0 112.283 170.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -129.51 75.49 79.85 Favored Pre-proline 0 N--CA 1.429 -1.481 0 CA-C-O 117.363 -1.304 . . . . 0.0 112.074 -176.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -73.27 -4.34 15.24 Favored 'Trans proline' 0 C--N 1.299 -2.026 0 CA-C-N 124.716 2.72 . . . . 0.0 114.324 -174.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -71.42 -34.01 69.94 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.279 1.831 . . . . 0.0 109.937 -177.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.465 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -65.69 -32.75 59.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 C-N-CA 124.578 1.151 . . . . 0.0 111.093 -177.248 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -65.41 -23.39 66.94 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.431 -1.418 . . . . 0.0 113.78 178.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -80.56 -51.42 8.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.878 -1.764 . . . . 0.0 111.068 169.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 17.1 p -79.41 -29.03 41.78 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 -168.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -56.97 -56.97 14.83 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 125.884 1.674 . . . . 0.0 114.03 175.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 mt -72.15 -35.14 68.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.351 -1.468 . . . . 0.0 112.078 -171.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -44.68 -37.21 3.54 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 116.366 1.987 . . . . 0.0 116.366 165.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.8 mt -72.61 -43.97 61.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.456 -2.027 . . . . 0.0 111.068 173.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.609 ' HB2' HD11 ' B' ' 206' ' ' LEU . 1.8 mt -70.52 -28.15 64.72 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.227 -2.171 . . . . 0.0 114.007 178.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.01 -32.25 70.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.6 -1.938 . . . . 0.0 112.274 173.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -53.93 -33.71 57.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 C-N-CA 125.224 1.41 . . . . 0.0 112.773 170.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.18 -62.45 1.46 Allowed 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.965 -1.084 . . . . 0.0 112.593 167.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . 0.328 0.0 OUTLIER -71.92 -17.69 62.07 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 117.18 2.289 . . . . 0.0 117.18 -165.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttpt -51.27 -29.95 16.29 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 128.157 2.583 . . . . 0.0 115.468 170.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -59.9 -30.73 69.22 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 125.465 1.506 . . . . 0.0 114.67 169.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -91.23 -72.58 0.57 Allowed 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.713 -1.242 . . . . 0.0 111.743 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.6 mt 45.17 -104.83 0.09 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 126.662 1.985 . . . . 0.0 115.35 -172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -93.39 9.92 34.4 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.832 1.653 . . . . 0.0 113.872 -172.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 77.5 p -112.49 146.56 38.25 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-O 123.946 1.831 . . . . 0.0 113.535 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 17.5 mmmt -116.94 166.93 11.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.855 2.062 . . . . 0.0 106.638 165.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 85.92 -29.75 4.52 Favored Glycine 0 N--CA 1.43 -1.719 0 O-C-N 120.351 -1.468 . . . . 0.0 115.635 172.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -59.94 157.4 30.73 Favored Pre-proline 0 N--CA 1.429 -1.495 0 N-CA-C 115.225 1.565 . . . . 0.0 115.225 -176.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -61.89 130.13 29.99 Favored 'Trans proline' 0 N--CA 1.433 -2.041 0 C-N-CA 122.76 2.307 . . . . 0.0 114.846 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -85.84 127.43 34.57 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 121.897 0.856 . . . . 0.0 110.307 177.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 79.1 mtp180 -131.59 -87.03 0.48 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.026 0.931 . . . . 0.0 108.767 174.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.4 62.75 1.32 Allowed Glycine 0 N--CA 1.43 -1.74 0 O-C-N 121.201 -0.937 . . . . 0.0 113.033 179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.293 21.0 ptt? 43.43 -123.35 0.79 Allowed 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.043 1.868 . . . . 0.0 116.043 165.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.1 m -108.15 122.85 47.75 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 148.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -62.24 -29.56 70.49 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.957 -1.714 . . . . 0.0 112.242 173.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -52.75 -29.42 27.06 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 116.988 2.218 . . . . 0.0 116.988 163.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.37 -30.84 27.1 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 118.737 -2.477 . . . . 0.0 111.012 -167.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.82 -30.66 47.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 CA-C-O 123.063 1.411 . . . . 0.0 111.163 179.391 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -66.96 -56.48 10.02 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.962 2.105 . . . . 0.0 112.824 162.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -51.06 -44.36 61.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.936 2.094 . . . . 0.0 115.545 -177.161 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.303 20.6 mt-10 -69.27 -52.54 26.58 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 120.621 -1.299 . . . . 0.0 110.246 179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.6 t -49.16 -32.54 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.768 2.027 . . . . 0.0 114.955 175.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.52 -28.84 67.35 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.517 -1.365 . . . . 0.0 112.679 -177.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -81.24 -28.32 34.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 121.206 -0.934 . . . . 0.0 112.224 176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.8 mp -68.41 -44.74 74.36 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.542 1.537 . . . . 0.0 112.1 173.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 7.5 m-30 -97.32 11.72 35.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.711 1.604 . . . . 0.0 110.104 -166.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.7 ptt180 -51.64 129.38 25.78 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -164.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.87 -31.65 7.07 Favored Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.659 -1.275 . . . . 0.0 113.18 -172.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -97.92 76.42 2.42 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 124.175 1.94 . . . . 0.0 111.68 -172.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -74.12 -18.57 60.78 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.683 2.393 . . . . 0.0 112.742 -174.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -56.29 -29.82 61.71 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.705 2.402 . . . . 0.0 113.087 172.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 85.9 mt -78.83 -50.58 11.04 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.603 -1.31 . . . . 0.0 112.479 174.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.52 -20.55 66.39 Favored 'General case' 0 N--CA 1.429 -1.51 0 O-C-N 119.835 -1.791 . . . . 0.0 114.016 -175.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 54.4 p -65.58 -48.43 72.39 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.631 -1.293 . . . . 0.0 113.325 174.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -73.3 -20.05 60.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.501 -1.374 . . . . 0.0 113.37 171.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -69.47 -23.41 63.64 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.352 -1.468 . . . . 0.0 112.054 170.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -69.11 -17.18 71.65 Favored Glycine 0 N--CA 1.431 -1.696 0 C-N-CA 128.526 2.965 . . . . 0.0 116.651 -178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -59.1 -46.79 87.4 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.671 -2.076 . . . . 0.0 114.385 -175.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -73.76 -50.13 22.15 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.099 1.36 . . . . 0.0 111.136 170.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 84.3 mt -81.9 152.83 69.42 Favored Pre-proline 0 N--CA 1.431 -1.41 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -161.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.91 106.45 2.14 Favored 'Trans proline' 0 C--N 1.3 -1.999 0 C-N-CA 122.51 2.14 . . . . 0.0 113.33 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -79.62 -70.69 0.49 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -154.41 -84.89 0.06 Allowed 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 -169.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -158.63 74.29 0.67 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.852 0.861 . . . . 0.0 109.409 161.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.281 0.0 OUTLIER . . . . . 0 C--O 1.259 1.601 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 167.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 CA--C 1.489 -1.372 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 18.8 mmt85 -122.3 143.05 49.86 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.587 -1.321 . . . . 0.0 108.324 174.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 6.1 ptp -80.14 72.4 6.94 Favored 'General case' 0 N--CA 1.431 -1.387 0 O-C-N 120.49 -1.381 . . . . 0.0 113.246 166.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -69.31 147.67 50.82 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 119.242 -2.161 . . . . 0.0 108.656 173.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . 0.31 0.9 OUTLIER -58.99 -23.3 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -164.076 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.82 -36.31 0.61 Allowed 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 164.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.4 mmt -50.86 -39.83 54.66 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.613 2.365 . . . . 0.0 114.017 172.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 82.6 mt -71.01 -30.59 66.87 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.81 1.411 . . . . 0.0 114.81 -173.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.609 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.0 mm? -79.52 -18.77 51.17 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.556 0.742 . . . . 0.0 111.79 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -81.76 -49.38 10.48 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 123.855 0.862 . . . . 0.0 111.138 171.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.21 -39.27 78.58 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 127.012 2.125 . . . . 0.0 113.539 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -62.76 -37.02 84.99 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 175.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -74.32 -40.66 62.08 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.726 -1.233 . . . . 0.0 111.458 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -56.23 -47.77 77.8 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.076 2.55 . . . . 0.0 113.441 173.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.2 mt -72.0 -21.48 61.56 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -177.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -62.92 -39.1 93.51 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.311 -1.493 . . . . 0.0 113.006 168.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.5 mtt180 -68.13 -20.44 64.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.732 -1.23 . . . . 0.0 113.15 -177.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -73.22 -29.05 62.53 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.992 -1.692 . . . . 0.0 113.329 173.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -76.14 -38.19 57.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.08 -1.012 . . . . 0.0 112.926 179.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -61.58 -37.61 84.49 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.095 -1.003 . . . . 0.0 113.004 175.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -66.9 -47.92 70.28 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 126.685 1.994 . . . . 0.0 112.063 174.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -62.89 -42.79 99.9 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.031 1.332 . . . . 0.0 114.442 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -75.95 -29.23 58.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -176.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.258 2.0 p-80 . . . . . 0 C--O 1.26 1.652 0 C-N-CA 127.083 2.153 . . . . 0.0 115.405 -177.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.49 -1.354 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 p -143.77 151.61 40.2 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.628 . . . . 0.0 114.97 170.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -121.04 -59.75 1.7 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.577 1.951 . . . . 0.0 109.585 -173.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.8 m -90.24 76.1 6.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 120.513 -1.367 . . . . 0.0 111.919 -178.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.2 t -78.54 -52.5 15.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.51 0 C-N-CA 126.528 1.931 . . . . 0.0 109.94 -172.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -71.07 -26.42 63.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.217 -0.927 . . . . 0.0 112.989 -177.032 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -63.29 -43.81 96.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 122.108 -0.37 . . . . 0.0 110.949 171.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.423 ' HA ' HG12 ' A' ' 11' ' ' ILE . 16.4 m-80 -79.35 -26.04 42.15 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.852 -1.155 . . . . 0.0 111.115 -173.049 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -65.12 -32.39 74.07 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.819 -1.176 . . . . 0.0 112.493 167.173 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.98 61.85 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.166 -0.959 . . . . 0.0 111.96 168.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.423 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.3 mm -55.28 -47.68 77.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 125.145 1.378 . . . . 0.0 113.249 179.265 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -53.0 -40.15 63.61 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.938 2.095 . . . . 0.0 113.382 175.592 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -67.6 -54.62 18.24 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.429 1.491 . . . . 0.0 111.973 176.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 4.0 t -57.05 -45.36 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.495 0 O-C-N 120.495 -1.378 . . . . 0.0 113.088 176.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -57.65 -39.83 77.94 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 115.597 1.702 . . . . 0.0 115.597 172.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.2 tttp -64.88 -41.08 95.92 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.396 -1.44 . . . . 0.0 113.588 176.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.8 mt -59.87 -52.39 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 C-N-CA 126.861 2.064 . . . . 0.0 110.595 172.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.76 -35.93 77.67 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.69 1.196 . . . . 0.0 113.092 -178.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 89.3 m -75.14 -35.33 61.67 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 178.214 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -88.72 -29.79 19.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 118.91 -2.369 . . . . 0.0 114.654 177.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -87.88 51.19 2.14 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.124 -1.61 . . . . 0.0 112.196 175.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.6 mt -84.27 -32.42 24.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.199 -1.563 . . . . 0.0 112.004 171.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -73.35 -18.25 61.2 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 121.235 -0.916 . . . . 0.0 112.003 171.268 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -128.81 66.48 75.52 Favored Pre-proline 0 N--CA 1.43 -1.453 0 O-C-N 120.765 -1.209 . . . . 0.0 110.386 -179.321 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -76.08 -0.21 10.05 Favored 'Trans proline' 0 N--CA 1.433 -2.032 0 C-N-CA 123.254 2.636 . . . . 0.0 113.39 -170.095 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -80.35 -20.55 43.89 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.348 1.459 . . . . 0.0 111.103 175.389 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.4 HD13 ' N ' ' A' ' 27' ' ' ILE . 0.9 OUTLIER -68.6 -37.01 77.05 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.244 -1.535 . . . . 0.0 108.965 174.612 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.5 -21.93 65.88 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.515 1.126 . . . . 0.0 113.722 176.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 20.4 mmt85 -80.77 -61.72 1.88 Allowed 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.849 -1.782 . . . . 0.0 111.962 163.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 70.2 m -76.13 -19.44 58.5 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.139 1.903 . . . . 0.0 116.139 -163.226 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -47.55 -53.87 13.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.646 1.578 . . . . 0.0 112.497 163.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 6.5 mt -75.99 -37.31 58.64 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.85 1.26 . . . . 0.0 112.565 -174.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -49.39 -41.18 38.63 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.653 1.353 . . . . 0.0 114.653 171.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.0 mt -65.2 -47.29 88.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 C-N-CA 125.664 1.586 . . . . 0.0 112.191 170.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.645 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.3 mt -64.04 -28.02 69.5 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.842 -2.411 . . . . 0.0 115.023 177.405 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -69.78 -30.27 67.79 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.975 -1.703 . . . . 0.0 112.754 171.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -60.69 -30.02 69.67 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 125.099 1.36 . . . . 0.0 112.797 170.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -74.61 -63.08 1.32 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.003 -1.061 . . . . 0.0 111.776 163.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.44 -18.37 60.65 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.856 2.169 . . . . 0.0 116.856 -158.322 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -52.51 -32.22 39.22 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 127.087 2.155 . . . . 0.0 114.172 172.657 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -64.87 -21.95 66.9 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.082 1.353 . . . . 0.0 114.548 178.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 14.6 tt0 -80.78 -20.76 41.9 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.414 1.486 . . . . 0.0 112.812 177.023 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 78.0 mt -92.12 11.27 26.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.901 -1.749 . . . . 0.0 113.444 -173.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 16.5 t-80 -89.57 -64.41 1.14 Allowed 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.951 -1.093 . . . . 0.0 113.049 -170.235 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.2 t -158.47 159.14 35.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.19 -0.944 . . . . 0.0 111.018 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -114.32 108.61 17.14 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.693 -1.254 . . . . 0.0 111.793 -167.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.87 -37.19 0.82 Allowed Glycine 0 N--CA 1.43 -1.743 0 O-C-N 121.179 -0.95 . . . . 0.0 113.984 179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -103.25 163.49 17.37 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.92 177.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -62.2 136.0 57.73 Favored 'Trans proline' 0 C--N 1.3 -1.997 0 C-N-CA 122.498 2.132 . . . . 0.0 114.554 176.153 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -65.79 -45.37 82.68 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.199 1.185 . . . . 0.0 114.199 -174.609 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 66.39 94.27 0.06 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 126.801 2.04 . . . . 0.0 113.543 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.54 68.4 0.4 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.308 5.8 ptt? 43.19 -140.38 0.18 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.398 2.279 . . . . 0.0 115.93 170.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.2 p -102.78 139.66 38.07 Favored 'General case' 0 N--CA 1.432 -1.373 0 O-C-N 120.673 -1.267 . . . . 0.0 110.064 163.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -63.83 -29.96 71.1 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.755 -1.841 . . . . 0.0 112.503 173.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -54.83 -31.03 58.84 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 116.548 2.055 . . . . 0.0 116.548 169.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.58 -35.92 24.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.13 -2.231 . . . . 0.0 110.836 -171.435 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -34.11 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 CA-C-O 123.045 1.402 . . . . 0.0 110.261 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -60.79 -57.28 13.35 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.191 2.196 . . . . 0.0 114.121 161.665 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -43.01 65.74 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.103 1.761 . . . . 0.0 114.683 -178.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.4 mm-40 -69.96 -48.35 58.68 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.787 -1.195 . . . . 0.0 110.31 -179.721 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.61 -37.83 32.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 125.991 1.717 . . . . 0.0 115.086 174.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.41 80.37 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.474 1.909 . . . . 0.0 111.464 -175.829 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -73.42 -28.84 62.2 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-O 121.529 0.681 . . . . 0.0 112.597 -178.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.482 HD12 ' O ' ' A' ' 61' ' ' GLU . 2.8 mp -73.85 -30.65 62.79 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.067 -1.02 . . . . 0.0 113.148 171.729 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -101.63 10.36 40.24 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.898 1.679 . . . . 0.0 111.167 -167.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -60.17 117.79 5.57 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -160.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.88 -38.16 3.24 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 125.045 1.307 . . . . 0.0 111.574 -172.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -83.54 71.35 10.34 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 124.189 1.947 . . . . 0.0 113.687 -174.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -64.09 -30.81 71.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.474 2.71 . . . . 0.0 115.4 -172.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -69.28 -18.62 63.86 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 127.536 2.335 . . . . 0.0 113.57 -176.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 93.6 mt -77.06 -51.44 11.06 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 124.76 1.224 . . . . 0.0 112.504 169.179 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.4 -24.14 67.14 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.251 -1.53 . . . . 0.0 113.812 -175.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 89.4 p -69.1 -40.81 78.17 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 121.069 -1.019 . . . . 0.0 113.257 175.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -76.82 -19.08 57.96 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.77 1.628 . . . . 0.0 112.931 173.028 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' HD11 ' B' ' 202' ' ' ILE . 0.4 OUTLIER -63.29 -25.62 68.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.649 -1.282 . . . . 0.0 112.608 169.324 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -52.23 -17.72 4.24 Favored Glycine 0 N--CA 1.43 -1.734 0 C-N-CA 129.432 3.396 . . . . 0.0 116.367 170.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -49.27 -36.26 20.11 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.034 1.734 . . . . 0.0 115.662 173.355 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -97.21 -49.05 5.11 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.21 -0.931 . . . . 0.0 109.51 168.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 mt -77.97 130.23 73.45 Favored Pre-proline 0 N--CA 1.43 -1.428 0 N-CA-C 116.205 1.928 . . . . 0.0 116.205 -153.873 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -71.65 116.23 4.62 Favored 'Trans proline' 0 N--CA 1.434 -2.014 0 C-N-CA 122.905 2.403 . . . . 0.0 115.033 171.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -74.25 -60.82 2.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 CA-C-N 118.794 0.724 . . . . 0.0 111.937 170.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -125.4 -40.3 2.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.252 1.021 . . . . 0.0 109.986 -170.712 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 17.0 tptp 70.05 62.01 0.24 Allowed 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 128.405 2.682 . . . . 0.0 112.875 -178.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 . . . . . 0 C--O 1.26 1.633 0 C-N-CA 126.317 1.847 . . . . 0.0 110.555 -179.52 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 17.7 t . . . . . 0 CA--C 1.49 -1.365 0 CA-C-O 120.795 0.331 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 70.1 mtt-85 -125.12 107.54 10.88 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.05 -1.031 . . . . 0.0 110.216 174.023 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.261 34.1 mtp 71.23 128.64 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 127.554 2.342 . . . . 0.0 113.214 179.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -164.57 168.01 18.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 -174.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.501 HD11 ' CE1' ' A' ' 76' ' ' PHE 0.252 2.4 mt -72.53 -27.17 25.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.627 -1.296 . . . . 0.0 110.903 167.555 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 tm0? -48.5 -40.44 26.64 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 115.624 1.713 . . . . 0.0 115.624 172.165 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 17.0 ttp -63.26 -24.81 68.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 174.355 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.8 mt -67.0 -36.8 82.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.981 -1.7 . . . . 0.0 115.005 178.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.645 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -72.88 -22.86 60.69 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 121.044 -1.035 . . . . 0.0 111.156 176.972 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -79.75 -43.82 21.86 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.616 -1.302 . . . . 0.0 110.992 174.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.61 -37.08 75.1 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.658 1.583 . . . . 0.0 114.817 173.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -67.57 -47.87 68.52 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 176.58 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.46 -20.38 60.03 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.024 -1.672 . . . . 0.0 112.636 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 28.6 t80 -65.38 -44.86 86.24 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.85 -1.781 . . . . 0.0 111.292 165.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -20.1 63.22 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.061 -1.649 . . . . 0.0 114.94 -179.682 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -65.32 -48.22 73.8 Favored 'General case' 0 N--CA 1.431 -1.389 0 O-C-N 120.063 -1.648 . . . . 0.0 112.791 161.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 21.4 ttm-85 -61.15 -34.94 75.82 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 126.344 1.857 . . . . 0.0 114.307 176.643 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -55.4 -34.55 64.48 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.419 1.488 . . . . 0.0 114.902 173.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -64.34 -33.08 75.01 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.447 -1.408 . . . . 0.0 114.262 174.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -77.18 -50.0 13.93 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.985 -1.072 . . . . 0.0 110.032 175.377 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 19.7 tt0 -47.84 -24.59 1.03 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 129.525 3.13 . . . . 0.0 116.53 -179.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -47.79 -28.59 2.61 Favored 'General case' 0 N--CA 1.428 -1.529 0 C-N-CA 127.337 2.255 . . . . 0.0 116.505 169.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 19.1 pt-20 -63.64 -32.34 73.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.304 -1.498 . . . . 0.0 113.858 173.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.257 99.8 m-70 . . . . . 0 C--O 1.261 1.673 0 C-N-CA 129.38 3.072 . . . . 0.0 117.197 178.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.491 -1.326 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.267 50.1 m 77.86 116.84 0.06 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.263 2.225 . . . . 0.0 113.054 177.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -96.56 -36.42 10.76 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.732 1.213 . . . . 0.0 110.751 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.6 m 64.09 59.86 1.04 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.466 1.906 . . . . 0.0 112.959 -177.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 87.8 t -66.0 -59.16 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 127.277 2.231 . . . . 0.0 111.76 -167.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -68.18 -25.83 65.44 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.523 -0.736 . . . . 0.0 112.895 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -64.04 -41.41 97.4 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 121.954 -0.466 . . . . 0.0 111.034 171.9 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.482 ' HA ' HG12 ' A' ' 11' ' ' ILE . 9.8 t-20 -81.32 -22.67 38.34 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 126.847 2.059 . . . . 0.0 110.414 -172.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -74.07 -30.99 62.66 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.834 -1.166 . . . . 0.0 112.005 166.447 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.8 -38.01 76.48 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.348 -1.47 . . . . 0.0 112.495 168.549 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.482 HG12 ' HA ' ' A' ' 8' ' ' ASN . 15.8 mm -56.97 -51.67 65.68 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 O-C-N 120.373 -1.455 . . . . 0.0 111.984 172.015 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.5 p -62.01 -29.86 70.56 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -65.4 -54.05 34.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.787 1.235 . . . . 0.0 112.799 170.282 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 24.1 t -62.21 -39.68 84.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 O-C-N 119.987 -1.695 . . . . 0.0 112.236 178.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -58.93 -44.44 91.33 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 169.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -59.83 -41.23 90.87 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.094 -1.629 . . . . 0.0 112.801 173.251 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 68.2 mt -57.15 -51.22 71.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 C-N-CA 126.334 1.853 . . . . 0.0 112.152 170.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.0 mtmp? -56.75 -46.57 81.32 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.356 -1.465 . . . . 0.0 114.443 175.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 79.9 m -66.84 -33.57 75.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.647 1.579 . . . . 0.0 113.731 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -70.61 -52.48 21.13 Favored 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 119.154 -2.216 . . . . 0.0 111.983 168.416 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -80.49 43.6 0.66 Allowed 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.061 1.745 . . . . 0.0 113.906 -173.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 69.9 mt -73.57 -36.79 65.64 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.064 -1.647 . . . . 0.0 109.376 165.588 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -70.82 -18.02 62.74 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 124.743 1.217 . . . . 0.0 113.41 169.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -128.39 63.03 62.31 Favored Pre-proline 0 N--CA 1.43 -1.466 0 O-C-N 120.164 -1.585 . . . . 0.0 114.49 -172.265 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -78.52 -16.55 13.29 Favored 'Trans proline' 0 N--CA 1.434 -1.987 0 C-N-CA 122.834 2.356 . . . . 0.0 114.332 -167.407 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -68.89 -30.84 69.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 126.403 1.881 . . . . 0.0 111.978 -176.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.4 mt -67.73 -21.47 27.31 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 129.212 3.005 . . . . 0.0 112.693 -176.933 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -63.09 -20.21 65.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.733 1.213 . . . . 0.0 112.852 173.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -80.27 -60.55 2.29 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.423 -2.048 . . . . 0.0 113.419 160.017 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.1 p -70.85 -31.82 68.64 Favored 'General case' 0 N--CA 1.431 -1.401 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -161.501 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -54.47 -51.31 65.42 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.559 1.144 . . . . 0.0 113.251 172.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.445 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.4 OUTLIER -74.28 -38.89 63.26 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.912 -1.118 . . . . 0.0 112.202 -177.094 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 93.4 mt-10 -54.32 -35.57 62.82 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.602 1.704 . . . . 0.0 115.602 175.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.36 -43.99 91.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 124.653 1.181 . . . . 0.0 112.191 171.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.563 HD13 HG23 ' B' ' 202' ' ' ILE . 2.5 mt -65.97 -37.42 85.94 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 118.71 -2.493 . . . . 0.0 113.91 174.689 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 92.5 m-70 -62.59 -27.51 69.24 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.859 1.664 . . . . 0.0 113.765 174.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.64 -38.61 64.26 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.681 1.592 . . . . 0.0 112.751 170.251 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.36 -60.82 2.2 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.819 -1.176 . . . . 0.0 110.85 167.172 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tm0? -64.59 -27.21 68.79 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 -159.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -56.26 -39.16 72.15 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.729 2.012 . . . . 0.0 115.304 174.599 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -72.57 -22.96 60.92 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.029 -1.669 . . . . 0.0 114.706 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -70.06 -10.37 58.49 Favored 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 118.218 2.673 . . . . 0.0 118.218 -168.296 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.2 mt -79.86 -125.03 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.373 -2.08 . . . . 0.0 112.826 174.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 91.0 m-70 -95.16 1.6 54.84 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 118.451 -2.656 . . . . 0.0 116.364 -174.015 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -63.24 146.34 53.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 121.451 1.932 . . . . 0.0 116.003 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.532 ' H ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -102.21 -170.07 1.76 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.63 1.972 . . . . 0.0 112.023 -166.536 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 112.04 -89.36 0.53 Allowed Glycine 0 N--CA 1.429 -1.77 0 O-C-N 120.641 -1.287 . . . . 0.0 112.164 174.375 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.4 ptt85 -123.76 169.89 9.55 Favored Pre-proline 0 N--CA 1.43 -1.47 0 O-C-N 121.166 -1.196 . . . . 0.0 109.379 -179.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -74.96 172.84 15.56 Favored 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 123.181 2.172 . . . . 0.0 112.644 166.648 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . 0.26 29.5 t80 82.37 128.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.178 2.191 . . . . 0.0 114.899 175.003 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -127.56 -76.03 0.57 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.552 1.541 . . . . 0.0 110.083 -173.07 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -76.16 106.73 2.2 Favored Glycine 0 N--CA 1.429 -1.786 0 C-N-CA 125.476 1.513 . . . . 0.0 113.579 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 ptt? -61.74 -143.73 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.327 3.851 . . . . 0.0 114.235 175.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 24.0 m -80.25 124.06 28.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.008 -1.682 . . . . 0.0 110.8 168.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.519 ' HB2' HD22 ' A' ' 80' ' ' LEU . 14.2 pt-20 -59.14 -26.34 64.65 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.995 1.379 . . . . 0.0 112.898 166.396 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.4 mp0 -59.93 -29.4 68.36 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.102 -1.623 . . . . 0.0 115.247 166.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -82.77 -37.28 24.8 Favored 'General case' 0 N--CA 1.431 -1.402 0 CA-C-N 122.02 2.191 . . . . 0.0 110.978 -176.216 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -35.37 74.91 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 125.105 1.362 . . . . 0.0 110.568 179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -61.12 -58.47 8.23 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.319 2.248 . . . . 0.0 113.792 160.184 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -48.16 -43.13 31.18 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.811 2.444 . . . . 0.0 115.979 -175.471 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.295 32.6 mt-10 -72.62 -52.77 14.01 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.923 -1.111 . . . . 0.0 112.005 176.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.412 ' HA ' HD13 ' A' ' 65' ' ' LEU . 64.8 t -48.56 -33.54 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 128.112 2.565 . . . . 0.0 114.716 176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.85 72.58 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.858 1.663 . . . . 0.0 113.388 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 14.9 m-80 -76.03 -32.14 59.21 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.345 1.069 . . . . 0.0 111.952 178.927 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 62' ' ' VAL . 7.3 mp -67.97 -39.47 83.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 123.394 1.569 . . . . 0.0 110.412 -178.758 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.8 m-30 -90.45 0.64 57.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.735 1.614 . . . . 0.0 110.576 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -66.89 131.5 46.03 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 123.704 1.716 . . . . 0.0 115.62 -167.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.79 -62.28 0.42 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 107.827 -2.109 . . . . 0.0 107.827 -159.521 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 1.9 pm0 -98.6 95.49 7.31 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-O 123.886 1.803 . . . . 0.0 113.429 -177.35 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -75.18 -26.67 59.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.741 2.016 . . . . 0.0 114.165 -176.007 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -58.9 -33.49 70.6 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.721 1.208 . . . . 0.0 113.238 -174.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 76.2 mt -65.31 -34.24 77.88 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.632 -1.293 . . . . 0.0 114.206 178.546 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.92 -24.12 58.45 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.563 -1.961 . . . . 0.0 112.439 176.653 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 12.5 t -65.76 -43.77 87.91 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 124.617 1.167 . . . . 0.0 110.381 174.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -70.48 -27.46 64.23 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.935 1.457 . . . . 0.0 114.935 171.409 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -63.92 -24.68 67.83 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.873 -1.142 . . . . 0.0 112.085 174.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -66.36 -18.87 67.99 Favored Glycine 0 N--CA 1.429 -1.777 0 C-N-CA 125.828 1.68 . . . . 0.0 114.506 177.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -75.55 -21.69 57.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.779 -1.424 . . . . 0.0 112.431 177.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -93.03 -8.87 41.69 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.843 1.257 . . . . 0.0 109.605 178.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.519 HD22 ' HB2' ' A' ' 55' ' ' GLU . 50.7 mt -115.17 80.64 7.35 Favored Pre-proline 0 N--CA 1.429 -1.484 0 O-C-N 120.818 -1.176 . . . . 0.0 112.08 177.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -74.57 170.2 20.83 Favored 'Trans proline' 0 N--CA 1.434 -2.018 0 C-N-CA 123.445 2.764 . . . . 0.0 112.467 -175.928 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -86.19 -74.09 0.43 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.728 -0.607 . . . . 0.0 111.735 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.96 -27.44 0.15 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 121.11 -0.994 . . . . 0.0 112.045 -179.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 65.3 mmtt 81.53 40.1 0.05 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.231 2.612 . . . . 0.0 111.618 178.936 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 . . . . . 0 C--O 1.259 1.598 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -175.235 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 43.0 t . . . . . 0 CA--C 1.49 -1.356 0 CA-C-O 121.494 0.664 . . . . 0.0 112.595 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 73.6 mtt-85 -140.08 -176.66 4.68 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 105.236 -2.135 . . . . 0.0 105.236 174.531 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 3.3 ttt -63.58 79.82 0.03 OUTLIER 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 178.548 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -138.0 173.01 12.08 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.186 1.794 . . . . 0.0 107.901 174.085 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.563 HG23 HD13 ' A' ' 35' ' ' LEU . 10.5 mm -52.38 -33.94 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.397 0 C-N-CA 127.338 2.255 . . . . 0.0 115.695 -175.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -49.78 -38.7 35.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.133 1.901 . . . . 0.0 116.133 173.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 7.0 ttp -69.72 -22.31 63.41 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.572 1.549 . . . . 0.0 114.066 -173.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 44.1 mt -62.73 -35.96 81.47 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.567 -1.333 . . . . 0.0 114.045 170.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.547 HD21 HD12 ' A' ' 35' ' ' LEU . 18.0 mt -82.26 -20.48 37.5 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-O 122.349 1.071 . . . . 0.0 109.511 -173.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -82.01 -47.35 12.76 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.48 1.112 . . . . 0.0 110.338 175.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -59.22 -41.67 89.2 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.854 1.662 . . . . 0.0 113.537 174.287 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.16 -44.11 97.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 177.185 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -73.62 -38.72 64.95 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.82 -1.175 . . . . 0.0 112.576 176.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -55.16 -46.05 75.74 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.924 1.69 . . . . 0.0 113.548 171.704 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.5 mt -71.52 -32.74 68.53 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.647 -1.283 . . . . 0.0 113.482 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -60.86 -33.83 73.68 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.359 -1.463 . . . . 0.0 113.269 169.582 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -75.66 -29.04 58.95 Favored 'General case' 0 N--CA 1.431 -1.378 0 C-N-CA 125.055 1.342 . . . . 0.0 114.486 172.093 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -64.15 -28.32 69.68 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.227 -1.546 . . . . 0.0 114.054 172.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -64.58 -26.33 68.36 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.868 -1.77 . . . . 0.0 113.775 177.196 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 14.6 ttp85 -71.36 -20.61 62.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 N-CA-C 115.432 1.641 . . . . 0.0 115.432 174.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -72.66 -43.84 62.64 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.921 -1.737 . . . . 0.0 110.626 170.357 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -59.27 -20.1 51.45 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.823 2.049 . . . . 0.0 115.985 -179.321 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -66.35 -20.84 66.19 Favored 'General case' 0 N--CA 1.429 -1.518 0 C-N-CA 126.037 1.735 . . . . 0.0 115.479 172.797 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.26 1.636 0 O-C-N 120.273 -1.517 . . . . 0.0 114.14 175.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 p -162.08 159.88 26.72 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.1 t70 72.35 -42.99 0.55 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.112 2.165 . . . . 0.0 114.424 -176.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.9 m -83.94 77.67 9.87 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.216 -1.552 . . . . 0.0 113.955 -177.503 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 94.3 t -72.04 -47.77 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 128.349 2.659 . . . . 0.0 111.623 -179.149 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 60.3 mt-10 -79.99 -17.52 52.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.101 0.96 . . . . 0.0 113.397 -176.869 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -65.34 -47.91 74.84 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 118.811 -1.156 . . . . 0.0 109.243 161.701 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.414 ' HA ' HG12 ' A' ' 11' ' ' ILE . 29.2 m-20 -66.85 -36.02 81.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 125.094 1.357 . . . . 0.0 113.381 -174.53 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 29.3 p30 -69.07 -34.42 75.12 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.651 -1.281 . . . . 0.0 113.088 176.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.78 -37.09 79.08 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 121.66 -0.65 . . . . 0.0 112.278 169.82 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.414 HG12 ' HA ' ' A' ' 8' ' ' ASN . 8.5 mm -59.47 -52.02 65.85 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.498 0 O-C-N 120.376 -1.452 . . . . 0.0 111.551 176.571 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 74.4 m -56.3 -31.62 63.84 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.221 1.408 . . . . 0.0 114.328 -179.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -67.83 -56.27 9.81 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.748 -1.22 . . . . 0.0 112.116 172.002 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.6 t -58.46 -39.02 73.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 119.798 -1.813 . . . . 0.0 113.578 176.691 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -60.33 -44.68 95.26 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.012 -1.68 . . . . 0.0 114.522 172.675 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 22.3 ttmm -61.8 -40.66 96.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.002 -1.686 . . . . 0.0 112.169 173.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 51.0 mt -57.72 -52.03 62.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 126.038 1.735 . . . . 0.0 111.554 174.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -37.17 81.04 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 125.563 1.545 . . . . 0.0 113.781 176.937 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.8 m -70.09 -39.07 75.76 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 125.437 1.495 . . . . 0.0 113.675 178.3 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.26 -30.88 25.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.404 -2.06 . . . . 0.0 113.688 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -89.9 43.49 1.15 Allowed 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.698 -1.251 . . . . 0.0 113.414 176.863 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.7 mt -76.38 -37.4 57.23 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.762 -1.836 . . . . 0.0 110.924 170.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -68.83 -17.4 64.0 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 126.113 1.765 . . . . 0.0 113.653 170.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.0 m80 -135.8 69.39 65.4 Favored Pre-proline 0 N--CA 1.431 -1.375 0 O-C-N 120.705 -1.247 . . . . 0.0 110.143 -174.221 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -74.53 -0.78 10.19 Favored 'Trans proline' 0 N--CA 1.434 -1.998 0 C-N-CA 123.461 2.774 . . . . 0.0 112.993 -174.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -66.72 -35.1 79.33 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.686 2.794 . . . . 0.0 110.584 176.747 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.435 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.2 mm -66.49 -37.95 80.69 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 C-N-CA 125.158 1.383 . . . . 0.0 111.366 -172.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -58.77 -29.11 66.54 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.567 1.547 . . . . 0.0 113.258 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 -73.95 -58.64 3.17 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 169.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 37.4 m -73.14 -29.41 62.86 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.41 -1.431 . . . . 0.0 113.713 -166.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -52.04 -53.7 38.97 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 172.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.3 OUTLIER -70.82 -35.19 72.38 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.817 -1.177 . . . . 0.0 112.783 -175.234 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -48.79 -44.76 39.28 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.643 1.977 . . . . 0.0 113.929 174.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 44.4 mt -64.6 -47.72 87.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 127.07 2.148 . . . . 0.0 111.617 171.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.65 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -67.33 -20.48 65.6 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 118.407 -2.683 . . . . 0.0 115.204 177.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -71.99 -29.52 64.31 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.678 -2.513 . . . . 0.0 113.203 172.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 11.2 m -60.31 -30.51 69.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.807 1.643 . . . . 0.0 112.506 171.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -72.1 -61.46 1.78 Allowed 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 125.662 1.585 . . . . 0.0 112.698 168.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -16.74 61.66 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 117.662 2.467 . . . . 0.0 117.662 -169.313 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.7 tptm -51.68 -35.66 43.49 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 128.398 2.679 . . . . 0.0 115.556 173.448 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -76.15 -22.47 55.39 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.623 -1.298 . . . . 0.0 113.462 177.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -95.85 -60.71 1.58 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 125.097 1.359 . . . . 0.0 111.982 -167.077 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 55.7 mt 46.33 -125.93 1.42 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 127.471 2.308 . . . . 0.0 115.246 -179.036 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -107.66 50.59 0.77 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.132 -1.605 . . . . 0.0 110.274 169.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . 0.315 50.8 p 55.7 76.31 0.28 Allowed 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 127.064 2.146 . . . . 0.0 113.876 -175.407 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -75.1 -37.29 61.56 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 121.087 -1.008 . . . . 0.0 110.926 -178.2 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -135.63 -57.58 0.06 OUTLIER Glycine 0 N--CA 1.429 -1.783 0 O-C-N 121.604 -0.685 . . . . 0.0 111.669 170.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.7 ptt-85 -111.5 146.33 34.43 Favored Pre-proline 0 N--CA 1.43 -1.45 0 C-N-CA 124.91 1.284 . . . . 0.0 111.292 -174.054 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -71.78 145.38 45.87 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.966 2.444 . . . . 0.0 112.983 165.009 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 13.2 t80 57.85 -138.33 0.88 Allowed 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.77 1.628 . . . . 0.0 114.011 176.279 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.25 23.8 mmm180 68.0 96.83 0.06 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.86 2.464 . . . . 0.0 115.268 178.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -127.85 82.43 0.34 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 119.781 -1.824 . . . . 0.0 109.754 -179.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 19.4 ptt? 29.67 -119.17 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 129.23 3.012 . . . . 0.0 116.781 172.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.0 m -105.4 122.33 45.75 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.997 1.319 . . . . 0.0 108.742 160.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -59.42 -29.58 67.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.583 -1.323 . . . . 0.0 112.421 170.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.36 -29.86 69.18 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.235 1.568 . . . . 0.0 115.235 170.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.51 -35.8 24.57 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 122.793 2.542 . . . . 0.0 110.624 -170.712 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -69.63 -32.87 54.17 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 CA-C-O 123.72 1.724 . . . . 0.0 110.753 -178.009 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -63.39 -53.32 54.27 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.88 2.472 . . . . 0.0 114.02 162.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.86 -43.1 48.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.655 2.382 . . . . 0.0 116.202 -176.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -72.19 -51.94 18.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 118.814 -0.613 . . . . 0.0 111.796 176.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.475 ' HA ' HD13 ' A' ' 65' ' ' LEU . 69.2 t -51.61 -31.83 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 127.78 2.432 . . . . 0.0 114.851 176.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -69.39 -21.67 63.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.394 1.877 . . . . 0.0 113.439 179.624 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.3 m-80 -74.8 -41.13 60.57 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 121.133 -0.979 . . . . 0.0 110.505 172.346 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.475 HD13 ' HA ' ' A' ' 62' ' ' VAL . 8.4 mp -64.94 -42.44 94.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.256 1.823 . . . . 0.0 111.95 -172.143 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 8.0 m-30 -96.28 0.03 50.33 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.354 1.462 . . . . 0.0 111.709 -164.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.78 133.53 26.1 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 117.085 2.254 . . . . 0.0 117.085 -158.232 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 114.74 -50.72 0.76 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 107.676 -2.17 . . . . 0.0 107.676 -172.39 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -83.54 99.26 10.04 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.377 1.071 . . . . 0.0 112.844 -175.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -73.89 -30.68 62.74 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.711 -1.243 . . . . 0.0 113.066 175.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -53.48 -38.47 63.66 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 128.973 2.909 . . . . 0.0 114.111 -176.346 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 67.3 mt -65.88 -53.4 40.14 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.858 -1.151 . . . . 0.0 113.846 173.095 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.69 -21.53 66.09 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.753 -1.842 . . . . 0.0 112.801 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 8.7 t -70.03 -46.28 65.4 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.055 2.142 . . . . 0.0 111.939 175.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 69.4 tt0 -73.78 -22.6 59.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.589 1.956 . . . . 0.0 113.102 172.758 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -64.58 -23.2 67.19 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 112.183 168.65 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.86 -16.07 58.85 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 128.394 2.902 . . . . 0.0 116.439 177.6 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.2 -37.17 86.18 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 120.58 2.19 . . . . 0.0 116.233 -176.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -84.13 -45.43 13.0 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.38 -1.45 . . . . 0.0 111.407 165.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 87.6 mt -77.08 166.74 42.33 Favored Pre-proline 0 N--CA 1.432 -1.362 0 N-CA-C 115.662 1.727 . . . . 0.0 115.662 -162.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -67.52 138.6 46.37 Favored 'Trans proline' 0 C--N 1.3 -2.023 0 C-N-CA 122.126 1.884 . . . . 0.0 114.287 172.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -73.68 -53.41 10.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.459 -0.776 . . . . 0.0 112.211 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.64 -56.37 0.13 Allowed 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 175.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt -164.2 82.78 0.42 Allowed 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 123.0 1.381 . . . . 0.0 109.26 -179.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 . . . . . 0 C--O 1.26 1.619 0 C-N-CA 127.198 2.199 . . . . 0.0 115.933 172.111 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 CA--C 1.49 -1.34 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.22 -178.77 5.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.693 -1.88 . . . . 0.0 110.269 172.487 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 70.3 mtp -80.66 -116.08 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 121.065 -1.022 . . . . 0.0 110.413 174.515 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 63.5 t30 78.55 155.86 0.16 Allowed 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.747 2.019 . . . . 0.0 111.927 179.262 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.06 -24.66 35.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 C-N-CA 125.529 1.532 . . . . 0.0 112.853 -177.375 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -44.84 -39.98 5.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.412 1.885 . . . . 0.0 116.076 171.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 51.7 mmm -57.27 -30.58 64.79 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 176.366 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 93.3 mt -69.28 -32.18 71.18 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -176.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.65 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.4 mm? -72.75 -25.97 61.39 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.07 0.948 . . . . 0.0 111.373 176.855 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -82.26 -47.71 12.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 124.422 1.089 . . . . 0.0 112.398 174.19 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.57 -34.53 69.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.209 1.803 . . . . 0.0 113.845 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.61 -51.51 69.51 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.055 1.342 . . . . 0.0 114.49 172.488 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -62.02 -44.2 97.21 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.795 1.638 . . . . 0.0 112.506 177.169 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 32.8 t80 -55.69 -44.52 77.44 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.8 2.04 . . . . 0.0 113.109 176.234 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.56 -22.94 61.68 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.4 -1.438 . . . . 0.0 114.753 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -64.07 -36.09 82.86 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.673 -1.267 . . . . 0.0 113.773 172.192 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -70.97 -37.39 72.77 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.655 1.582 . . . . 0.0 111.983 175.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -62.79 -26.86 68.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.496 1.295 . . . . 0.0 114.496 176.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -56.55 -46.76 80.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 171.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -74.36 -35.27 63.54 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 123.76 0.824 . . . . 0.0 112.271 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -70.93 -25.74 62.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.163 -1.586 . . . . 0.0 114.72 176.002 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.97 -24.12 64.21 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.177 -1.577 . . . . 0.0 113.876 173.487 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -67.24 -51.91 47.37 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 124.624 1.17 . . . . 0.0 110.445 174.454 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 1.8 t60 . . . . . 0 C--O 1.26 1.646 0 C-N-CA 126.082 1.753 . . . . 0.0 115.295 159.419 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 . . . . . 0 CA--C 1.489 -1.38 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.1 t 84.49 138.4 0.06 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.386 2.275 . . . . 0.0 112.516 168.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -93.8 -20.0 20.5 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.369 -0.832 . . . . 0.0 110.812 -178.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 61.5 m -85.66 67.73 10.17 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 124.148 1.928 . . . . 0.0 112.319 178.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 75.9 t -75.16 -49.82 26.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 128.045 2.538 . . . . 0.0 110.216 -175.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 72.2 mt-10 -73.55 -18.96 61.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 120.56 -1.338 . . . . 0.0 113.783 -177.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -61.95 -45.58 93.06 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.623 -0.673 . . . . 0.0 110.484 166.232 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.466 ' HA ' HG12 ' A' ' 11' ' ' ILE . 54.4 t30 -77.34 -27.14 52.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 126.979 2.112 . . . . 0.0 111.623 -174.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 -77.54 -23.94 50.02 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 119.969 -1.707 . . . . 0.0 111.556 174.466 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.86 -46.27 75.51 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.812 -1.18 . . . . 0.0 111.455 162.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.466 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.3 mm -55.36 -46.78 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.42 -1.425 . . . . 0.0 114.013 177.484 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.0 t -63.57 -24.64 67.89 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 114.154 1.168 . . . . 0.0 114.154 -179.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -71.56 -50.25 32.9 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.518 . . . . 0.0 111.538 169.257 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 19.6 t -58.66 -42.37 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.494 0 O-C-N 120.086 -1.634 . . . . 0.0 113.307 175.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -62.99 -35.76 81.27 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 172.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -62.74 -45.65 91.75 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.716 -1.865 . . . . 0.0 110.991 171.023 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 60.5 mt -56.15 -46.34 81.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 126.809 2.043 . . . . 0.0 112.771 172.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -55.91 -49.0 74.65 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.296 -1.502 . . . . 0.0 113.373 173.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.4 m -59.55 -38.1 80.19 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.077 1.751 . . . . 0.0 114.003 -178.24 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 29.7 mmm180 -81.65 -29.36 33.18 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.132 -2.23 . . . . 0.0 114.301 177.308 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 27.1 m-85 -102.19 39.23 1.52 Allowed 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.711 -1.243 . . . . 0.0 111.657 -179.216 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.8 mt -71.77 -45.5 61.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.437 -1.414 . . . . 0.0 112.731 173.508 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.4 12.93 21.04 Favored 'General case' 0 N--CA 1.429 -1.488 0 CA-C-O 121.81 0.814 . . . . 0.0 110.551 173.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 21.7 m80 -132.11 59.54 44.91 Favored Pre-proline 0 N--CA 1.43 -1.43 0 CA-C-O 116.703 -1.618 . . . . 0.0 112.579 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_exo -76.29 -1.16 11.16 Favored 'Trans proline' 0 C--N 1.3 -2.017 0 CA-C-N 126.477 3.349 . . . . 0.0 114.017 -168.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 11.7 mt-10 -67.95 -31.78 71.76 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.9 1.68 . . . . 0.0 110.79 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.457 HG23 ' HB3' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.14 -41.63 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.389 0 C-N-CA 125.471 1.508 . . . . 0.0 109.049 -179.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -65.25 -19.51 66.0 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.386 1.254 . . . . 0.0 114.386 -175.456 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.5 mmt85 -80.46 -60.73 2.21 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.254 -1.529 . . . . 0.0 111.569 162.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 t -73.91 -27.75 61.19 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 -161.828 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -51.09 -52.69 41.15 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.993 1.717 . . . . 0.0 113.535 168.718 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.19 -34.62 59.31 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.599 -1.313 . . . . 0.0 111.638 -174.11 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 85.5 mt-10 -48.94 -39.69 27.29 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.745 1.757 . . . . 0.0 115.745 169.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 61.6 mt -64.6 -48.15 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 125.286 1.434 . . . . 0.0 112.071 171.077 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.608 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.0 mt -67.15 -29.56 69.29 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.038 -2.289 . . . . 0.0 113.841 177.295 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 76.9 m-70 -67.36 -21.15 65.64 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.905 2.082 . . . . 0.0 112.869 171.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -63.08 -31.98 73.25 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 120.211 1.369 . . . . 0.0 111.627 170.85 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -80.36 -62.44 1.68 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.503 1.121 . . . . 0.0 111.33 166.148 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.63 -22.74 57.34 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -163.275 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -47.28 -26.28 1.19 Allowed 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 129.124 2.97 . . . . 0.0 116.812 164.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -52.91 -47.56 67.89 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.4 2.28 . . . . 0.0 115.898 167.478 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 66.31 4.11 3.06 Favored 'General case' 0 N--CA 1.429 -1.497 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.65 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 58.8 mt 59.22 89.09 0.06 Allowed 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 129.037 2.935 . . . . 0.0 116.389 175.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -88.68 49.81 1.85 Allowed 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 119.74 -1.85 . . . . 0.0 112.9 -179.265 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.4 t -110.04 -170.54 1.67 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.511 1.524 . . . . 0.0 108.24 174.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -74.23 -57.5 3.91 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.881 -1.762 . . . . 0.0 110.726 176.653 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 175.85 32.99 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.709 0 O-C-N 121.473 -0.767 . . . . 0.0 114.707 170.468 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptt180 -100.84 163.84 17.28 Favored Pre-proline 0 N--CA 1.43 -1.447 0 CA-C-N 118.558 1.179 . . . . 0.0 110.533 177.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_exo -66.65 150.74 83.65 Favored 'Trans proline' 0 N--CA 1.433 -2.034 0 CA-C-N 122.315 1.863 . . . . 0.0 113.5 171.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -120.65 -156.52 0.68 Allowed 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 124.983 1.313 . . . . 0.0 107.878 -175.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 5.7 ptp180 -94.66 -132.41 0.17 Allowed 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 107.02 -1.474 . . . . 0.0 107.02 161.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 164.41 71.59 0.03 OUTLIER Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 105.254 -3.139 . . . . 0.0 105.254 -173.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.381 0.0 OUTLIER 47.69 -134.78 1.09 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.075 1.75 . . . . 0.0 113.178 -161.762 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.6 m -79.76 110.19 14.88 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 159.515 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -65.62 -30.79 71.55 Favored 'General case' 0 CA--C 1.489 -1.385 0 O-C-N 120.376 -1.453 . . . . 0.0 112.31 -178.422 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -60.52 -20.88 61.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.531 2.048 . . . . 0.0 116.531 164.363 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -83.77 -38.13 21.71 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 121.931 2.15 . . . . 0.0 110.458 -174.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.2 -40.28 88.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 C-N-CA 124.936 1.294 . . . . 0.0 109.252 -179.285 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -56.84 -56.99 14.53 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.534 2.334 . . . . 0.0 114.575 162.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.01 -43.11 50.42 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 126.933 2.093 . . . . 0.0 114.529 -179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.507 ' O ' HD12 ' A' ' 65' ' ' LEU . 6.1 mm-40 -73.0 -50.05 25.36 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 123.936 0.894 . . . . 0.0 110.618 179.374 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' A' ' 65' ' ' LEU . 54.8 t -52.22 -36.19 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.427 0 C-N-CA 125.904 1.682 . . . . 0.0 115.125 175.063 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.57 -34.52 77.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.884 1.674 . . . . 0.0 112.354 177.411 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -70.42 -29.2 65.74 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.177 -0.952 . . . . 0.0 112.24 -177.66 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.507 HD12 ' O ' ' A' ' 61' ' ' GLU . 4.8 mp -73.35 -41.48 63.38 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.142 0.977 . . . . 0.0 112.766 173.349 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 10.0 m-30 -91.16 -18.1 25.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.364 1.466 . . . . 0.0 111.703 -163.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -15.91 125.71 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.488 1 C-N-CA 132.893 4.477 . . . . 0.0 120.562 -178.493 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 103.78 -45.48 1.32 Allowed Glycine 0 N--CA 1.43 -1.741 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -172.774 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -84.99 100.02 11.38 Favored 'General case' 0 N--CA 1.429 -1.503 0 CA-C-O 122.716 1.246 . . . . 0.0 111.048 -178.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -73.91 -26.89 60.76 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.816 -1.177 . . . . 0.0 113.062 176.412 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -42.07 -54.58 3.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 129.967 3.307 . . . . 0.0 114.165 176.693 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 55.9 mt -67.93 -42.6 80.79 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.547 1.139 . . . . 0.0 113.804 -175.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.78 -23.78 55.92 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.85 -1.781 . . . . 0.0 111.926 -178.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 24.6 t -64.48 -53.29 50.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.301 1.44 . . . . 0.0 111.612 175.626 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -72.76 -17.73 61.57 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.417 1.487 . . . . 0.0 113.571 175.148 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -64.77 -27.55 68.97 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 119.982 -1.699 . . . . 0.0 112.609 167.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -61.17 -15.56 44.79 Favored Glycine 0 N--CA 1.43 -1.726 0 C-N-CA 129.829 3.585 . . . . 0.0 117.454 -179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -46.17 -46.47 17.36 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 175.048 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 29.7 t80 -90.0 -47.51 7.8 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.788 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -80.81 168.92 21.75 Favored Pre-proline 0 N--CA 1.429 -1.487 0 N-CA-C 116.449 2.018 . . . . 0.0 116.449 -161.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -63.3 164.42 20.23 Favored 'Trans proline' 0 N--CA 1.434 -2.01 0 CA-C-N 123.556 2.306 . . . . 0.0 117.341 -177.341 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 40.39 84.64 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 128.911 2.884 . . . . 0.0 117.801 -174.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -163.61 82.19 0.45 Allowed 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 178.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -70.56 -48.16 56.74 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.261 1.668 0 C-N-CA 124.536 1.135 . . . . 0.0 110.782 171.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 120.848 0.356 . . . . 0.0 111.769 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -123.13 59.43 1.08 Allowed 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.646 1.579 . . . . 0.0 107.796 174.564 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.7 mtp 67.08 152.74 0.08 Allowed 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 128.389 2.676 . . . . 0.0 116.103 -171.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 23.9 p30 -174.96 -178.21 1.2 Allowed 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.431 2.292 . . . . 0.0 104.963 178.445 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -80.1 -23.46 11.67 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 O-C-N 120.732 -1.23 . . . . 0.0 112.406 169.197 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -51.67 -38.82 56.64 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.898 1.679 . . . . 0.0 115.304 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 3.9 mmt -51.11 -35.11 33.6 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 116.078 1.881 . . . . 0.0 116.078 170.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 57.1 mt -67.25 -30.77 70.75 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.679 -1.888 . . . . 0.0 115.676 -172.431 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.608 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.6 mm? -79.12 -23.25 44.17 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.02 0.928 . . . . 0.0 110.688 179.213 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . 0.314 3.4 pt-20 -83.52 -44.41 14.7 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.824 0.821 . . . . 0.0 112.192 174.441 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.54 80.17 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.766 2.027 . . . . 0.0 114.883 175.503 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -59.74 -50.03 75.42 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.868 -1.145 . . . . 0.0 113.656 173.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -69.49 -35.43 75.56 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.585 1.554 . . . . 0.0 112.615 -177.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -57.24 -46.78 82.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 127.279 2.232 . . . . 0.0 113.032 168.284 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.44 -26.67 64.71 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.577 -1.327 . . . . 0.0 114.549 -177.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -58.21 -33.49 69.35 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.239 -1.538 . . . . 0.0 114.407 171.074 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 49.7 mtt85 -75.69 -23.83 56.21 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.221 -1.549 . . . . 0.0 114.573 174.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -72.67 -29.0 63.05 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.042 -1.661 . . . . 0.0 113.19 177.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -61.72 -38.62 88.57 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.54 1.536 . . . . 0.0 114.302 176.447 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -73.91 -35.41 64.63 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.808 -1.182 . . . . 0.0 113.021 174.78 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -66.41 -29.2 69.31 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.179 1.391 . . . . 0.0 114.7 175.292 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -52.13 -21.15 3.01 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 128.322 2.649 . . . . 0.0 117.852 -175.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -66.31 -21.58 66.26 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 125.32 1.448 . . . . 0.0 113.567 175.095 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 120.934 -1.103 . . . . 0.0 108.94 174.682 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 . . . . . 0 CA--C 1.491 -1.32 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m 118.84 167.4 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 131.395 3.878 . . . . 0.0 110.486 173.345 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -82.82 -46.52 12.97 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.879 -1.138 . . . . 0.0 109.315 164.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.5 p -84.23 74.38 10.32 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.875 1.67 . . . . 0.0 113.451 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 47.5 t -80.52 -61.72 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.02 1.728 . . . . 0.0 110.733 -176.263 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -78.4 -19.7 52.75 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.446 -1.409 . . . . 0.0 112.663 -174.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -44.08 84.03 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.595 -0.691 . . . . 0.0 112.564 161.48 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.449 ' HA ' HG12 ' A' ' 11' ' ' ILE . 65.9 t30 -71.13 -22.92 62.01 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.047 1.739 . . . . 0.0 110.733 -178.723 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.3 m-80 -76.66 -26.6 55.0 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.343 -1.473 . . . . 0.0 111.321 172.326 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.11 -40.56 68.08 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.222 -1.549 . . . . 0.0 112.293 167.26 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 8' ' ' ASN . 17.0 mm -57.41 -45.79 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 O-C-N 120.338 -1.476 . . . . 0.0 112.821 174.034 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.6 t -51.6 -36.9 47.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 127.022 2.129 . . . . 0.0 113.486 172.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -74.2 -55.07 6.49 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.848 -1.158 . . . . 0.0 111.754 177.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.5 t -55.6 -44.68 77.53 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.382 0 C-N-CA 126.016 1.726 . . . . 0.0 113.456 178.256 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -61.72 -39.78 92.72 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 176.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -65.29 -37.49 87.32 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.112 -1.618 . . . . 0.0 113.427 172.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -62.57 -48.99 85.6 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 125.961 1.704 . . . . 0.0 109.994 175.416 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.74 -38.51 90.79 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 124.669 1.187 . . . . 0.0 113.919 179.084 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.5 m -71.36 -38.86 71.55 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.409 1.484 . . . . 0.0 114.567 174.216 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -72.02 -40.32 68.54 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 118.376 -2.702 . . . . 0.0 113.74 174.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -86.29 47.12 1.42 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 0.0 114.112 177.546 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.6 mt -80.32 -32.58 37.94 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.917 -1.739 . . . . 0.0 111.429 167.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.51 -26.73 67.3 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.514 1.126 . . . . 0.0 113.275 166.073 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 25.4 m-70 -128.63 66.28 74.22 Favored Pre-proline 0 N--CA 1.43 -1.472 0 O-C-N 120.815 -1.178 . . . . 0.0 110.417 -173.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -77.54 4.1 6.26 Favored 'Trans proline' 0 C--N 1.299 -2.065 0 CA-C-N 124.035 2.477 . . . . 0.0 112.949 -169.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -78.73 -22.61 46.28 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.229 1.412 . . . . 0.0 111.505 173.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.5 mm -63.16 -38.68 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.517 0 O-C-N 120.59 -1.319 . . . . 0.0 110.55 -179.853 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -56.07 -27.91 55.43 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 126.12 1.768 . . . . 0.0 114.118 177.325 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -80.32 -51.88 8.36 Favored 'General case' 0 N--CA 1.429 -1.505 0 O-C-N 120.608 -1.308 . . . . 0.0 112.239 175.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 46.2 m -80.2 -27.03 38.93 Favored 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -174.33 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -54.55 -56.31 20.25 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.27 -1.519 . . . . 0.0 113.864 176.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.6 OUTLIER -73.44 -34.48 65.44 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.99 -1.068 . . . . 0.0 111.987 -174.657 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -41.26 -50.13 3.65 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.505 1.669 . . . . 0.0 115.505 166.174 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 55.6 mt -62.79 -42.85 97.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.887 1.675 . . . . 0.0 112.046 172.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 206' ' ' LEU . 3.7 mt -73.4 -19.27 61.02 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 117.447 -3.283 . . . . 0.0 114.761 177.97 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.42 ' CE1' HD12 ' B' ' 206' ' ' LEU . 93.1 m-70 -72.91 -23.11 60.67 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.562 -1.961 . . . . 0.0 112.407 171.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.9 m -60.65 -35.4 76.12 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.027 -1.671 . . . . 0.0 111.371 166.945 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.513 ' HB2' HG21 ' A' ' 58' ' ' VAL . 57.0 t80 -78.68 -62.22 1.76 Allowed 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.84 1.656 . . . . 0.0 114.449 178.474 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -59.17 -33.08 70.5 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.953 1.701 . . . . 0.0 114.696 -166.666 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -45.53 -36.0 4.29 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 129.235 3.014 . . . . 0.0 116.985 169.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -61.83 -31.53 71.78 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.309 -1.494 . . . . 0.0 115.02 -178.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.18 -32.23 55.97 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.794 1.237 . . . . 0.0 112.424 -167.108 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -84.19 84.64 7.54 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.263 1.825 . . . . 0.0 111.695 -172.367 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 40.6 m170 -85.71 58.53 5.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.437 -2.04 . . . . 0.0 113.925 -167.538 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.5 t -85.41 159.69 19.92 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.639 -1.288 . . . . 0.0 112.142 179.552 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -88.99 132.25 34.81 Favored 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.133 -1.604 . . . . 0.0 110.254 179.947 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 165.19 -67.9 0.2 Allowed Glycine 0 N--CA 1.43 -1.76 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 -173.31 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -131.34 161.23 63.2 Favored Pre-proline 0 N--CA 1.43 -1.467 0 C-N-CA 125.434 1.494 . . . . 0.0 109.457 177.273 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -74.71 160.05 41.5 Favored 'Trans proline' 0 C--N 1.301 -1.97 0 C-N-CA 122.749 2.299 . . . . 0.0 112.001 168.886 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -115.9 160.84 19.67 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.609 1.195 . . . . 0.0 112.604 -173.484 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -106.27 -120.09 0.23 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 123.924 0.89 . . . . 0.0 109.792 176.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 96.95 163.85 32.43 Favored Glycine 0 N--CA 1.429 -1.769 0 O-C-N 121.01 -1.056 . . . . 0.0 113.317 -170.457 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.408 ' HE3' ' HB ' ' A' ' 58' ' ' VAL . 7.8 ptt? -156.9 -155.54 0.54 Allowed 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.865 1.266 . . . . 0.0 111.076 -165.259 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.4 m -110.12 149.65 29.74 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 121.303 -0.873 . . . . 0.0 110.248 174.269 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -46.23 -37.97 7.86 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 130.412 3.485 . . . . 0.0 115.509 -179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -55.08 -33.17 62.53 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 116.358 1.984 . . . . 0.0 116.358 178.49 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -83.78 -28.8 27.89 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.205 -1.559 . . . . 0.0 111.008 -171.864 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.513 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -72.99 -30.06 30.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 CA-C-O 123.007 1.384 . . . . 0.0 111.284 -177.768 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -63.96 -54.09 39.96 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.63 1.972 . . . . 0.0 112.225 160.51 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -42.18 72.19 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 116.853 2.168 . . . . 0.0 116.853 -175.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.409 ' O ' HD12 ' A' ' 65' ' ' LEU 0.259 22.9 mt-10 -72.48 -42.86 64.45 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.635 -1.291 . . . . 0.0 112.421 179.074 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 49.1 t -54.51 -36.53 35.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.209 2.204 . . . . 0.0 114.2 173.392 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.18 -30.8 71.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.773 1.629 . . . . 0.0 112.531 -174.448 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -75.02 -31.44 61.36 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 121.278 -0.889 . . . . 0.0 111.809 178.32 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' ' 27' ' ' ILE . 3.8 mp -74.07 -29.46 61.89 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-O 122.491 1.138 . . . . 0.0 111.996 -179.288 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -101.1 -1.53 33.85 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.567 1.547 . . . . 0.0 111.049 -170.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.7 130.23 9.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 118.719 2.859 . . . . 0.0 118.719 -164.457 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.98 -30.53 9.24 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 124.776 1.179 . . . . 0.0 112.092 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -92.21 79.0 5.11 Favored 'General case' 0 N--CA 1.429 -1.477 0 CA-C-O 124.161 1.934 . . . . 0.0 112.232 -172.387 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -65.45 -27.18 68.33 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 127.912 2.485 . . . . 0.0 114.117 -173.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -61.19 -32.56 72.31 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.569 -1.332 . . . . 0.0 112.727 176.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 83.4 mt -74.13 -47.89 33.04 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.576 -1.328 . . . . 0.0 112.995 178.079 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.48 -19.67 62.17 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 118.949 -2.344 . . . . 0.0 113.425 -178.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 30.8 t -63.68 -52.7 59.51 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.709 1.604 . . . . 0.0 110.666 169.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.8 -20.63 65.21 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.899 1.68 . . . . 0.0 114.811 175.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CE1' HD11 ' B' ' 202' ' ' ILE . 21.4 t80 -65.78 -27.62 68.41 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 124.764 1.225 . . . . 0.0 111.981 170.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -75.34 -21.44 77.65 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.923 1.725 . . . . 0.0 116.352 -169.992 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.6 pt20 -75.61 -22.24 57.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 119.932 1.866 . . . . 0.0 112.714 -178.634 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -79.82 -33.29 40.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.85 1.66 . . . . 0.0 110.969 179.088 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 93.8 mt -78.2 146.67 71.39 Favored Pre-proline 0 N--CA 1.429 -1.477 0 C-N-CA 123.552 0.741 . . . . 0.0 112.66 177.541 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -73.7 174.6 12.0 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 C-N-CA 123.155 2.57 . . . . 0.0 113.18 -175.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -75.15 -50.56 15.92 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 -179.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -152.78 -44.63 0.1 Allowed 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.77 -1.206 . . . . 0.0 109.493 -179.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.286 31.2 tttt 84.57 38.33 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 127.901 2.48 . . . . 0.0 111.327 173.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.311 7.0 mpt_? . . . . . 0 C--O 1.259 1.556 0 N-CA-C 119.303 3.075 . . . . 0.0 119.303 177.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.259 13.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.204 1.478 . . . . 0.0 113.463 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 59.7 mtt-85 -135.56 47.02 2.32 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 118.941 -2.349 . . . . 0.0 113.074 -177.627 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 42.1 mtt -80.24 161.11 25.33 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.881 -1.762 . . . . 0.0 113.524 174.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -176.26 -170.5 0.36 Allowed 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 102.797 -3.038 . . . . 0.0 102.797 160.298 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.418 HD11 ' CE1' ' A' ' 76' ' ' PHE . 3.1 mm -62.02 -26.92 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.16 1.784 . . . . 0.0 113.971 174.471 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -48.39 -34.36 10.69 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 117.45 2.389 . . . . 0.0 117.45 178.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -45.6 -42.66 11.47 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.13 2.172 . . . . 0.0 115.632 170.602 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 46.6 mt -69.38 -28.96 66.64 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -171.717 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.654 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.3 mm? -77.69 -26.68 50.4 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.758 1.223 . . . . 0.0 110.463 177.616 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -81.29 -50.09 9.94 Favored 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 121.276 -0.89 . . . . 0.0 109.849 178.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.58 -38.94 75.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.815 1.646 . . . . 0.0 114.131 178.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -63.9 -51.1 66.08 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 172.77 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -61.93 -38.58 88.99 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.745 -1.222 . . . . 0.0 112.736 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -57.5 -53.65 55.8 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.605 1.962 . . . . 0.0 113.494 170.137 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 5.8 mt -66.78 -30.82 71.12 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.8 -1.813 . . . . 0.0 114.668 -177.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.34 -27.13 68.84 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.526 -1.358 . . . . 0.0 114.53 170.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -69.52 -41.07 76.5 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.006 -1.684 . . . . 0.0 111.614 173.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -62.23 -30.35 71.04 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.1 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.55 -51.18 64.14 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.908 -1.12 . . . . 0.0 113.853 171.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 18.9 mtm180 -70.28 -36.41 74.37 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.184 1.394 . . . . 0.0 114.166 -178.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -53.98 -36.1 62.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.753 2.021 . . . . 0.0 115.364 177.231 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.32 -20.7 65.72 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 115.888 1.81 . . . . 0.0 115.888 179.191 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -73.88 -18.77 60.87 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.016 1.326 . . . . 0.0 113.28 173.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 . . . . . 0 C--O 1.261 1.677 0 C-N-CA 131.164 3.786 . . . . 0.0 120.741 171.392 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.49 -1.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 75.5 m 70.2 118.02 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.853 2.461 . . . . 0.0 115.402 172.596 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -95.46 -27.79 15.23 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.232 -1.542 . . . . 0.0 112.89 -173.512 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . 0.286 67.2 m 83.4 59.64 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.901 2.48 . . . . 0.0 111.869 -173.414 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 45.3 t -79.77 -51.32 16.54 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 C-N-CA 127.697 2.399 . . . . 0.0 111.54 -178.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . 0.253 54.0 mt-10 -74.42 -17.13 60.84 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.735 -1.228 . . . . 0.0 111.974 -175.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -52.08 -51.56 56.88 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 123.748 0.819 . . . . 0.0 113.14 158.676 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.498 ' HA ' HG12 ' A' ' 11' ' ' ILE . 91.1 m-20 -76.25 -23.19 54.5 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.8 2.04 . . . . 0.0 112.362 -175.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -79.31 -22.52 44.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 121.425 -0.797 . . . . 0.0 112.476 169.46 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.21 -42.11 72.77 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.41 -1.431 . . . . 0.0 110.493 165.647 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.498 HG12 ' HA ' ' A' ' 8' ' ' ASN . 18.9 mm -55.89 -54.11 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.935 1.294 . . . . 0.0 112.685 174.129 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 80.3 p -61.65 -28.52 69.44 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 178.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.58 -52.0 36.48 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 170.663 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.436 HG21 ' HB3' ' B' ' 208' ' ' ALA . 39.4 t -59.85 -41.0 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 O-C-N 120.465 -1.397 . . . . 0.0 112.081 175.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -54.71 -46.52 74.2 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 168.428 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.0 mtpp -60.69 -42.27 96.8 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 119.47 -2.019 . . . . 0.0 114.235 174.345 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 94.5 mt -61.01 -48.46 88.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 126.24 1.816 . . . . 0.0 111.419 175.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.12 -44.73 87.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.182 1.393 . . . . 0.0 112.292 177.652 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 15.2 m -67.09 -36.57 82.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.834 1.254 . . . . 0.0 113.321 -179.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -68.75 -46.19 69.46 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.593 -1.942 . . . . 0.0 114.338 173.535 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -90.73 42.51 1.1 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.864 -1.148 . . . . 0.0 113.432 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.35 -29.52 30.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.823 -1.798 . . . . 0.0 112.034 173.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.7 p30 -72.47 -21.27 61.24 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 122.177 0.989 . . . . 0.0 112.566 172.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -132.53 73.42 76.75 Favored Pre-proline 0 N--CA 1.43 -1.469 0 C-N-CA 124.793 1.237 . . . . 0.0 110.334 -177.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -77.39 -0.16 10.34 Favored 'Trans proline' 0 N--CA 1.434 -2.003 0 C-N-CA 122.882 2.388 . . . . 0.0 113.817 -165.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -80.79 -23.26 39.42 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.085 -1.009 . . . . 0.0 111.338 173.788 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.457 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.0 OUTLIER -68.78 -43.09 83.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 O-C-N 120.842 -1.161 . . . . 0.0 109.408 -178.487 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -53.3 -41.62 65.82 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 126.474 1.909 . . . . 0.0 113.346 175.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 41.2 mmt180 -79.67 -47.31 15.59 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.152 -0.967 . . . . 0.0 112.502 177.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 11.1 t -71.68 -28.71 63.91 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.61 -1.306 . . . . 0.0 114.037 -170.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . 0.282 0.4 OUTLIER -60.11 -38.62 83.53 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.08 -1.638 . . . . 0.0 115.327 170.188 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.65 -42.24 78.21 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.865 -1.147 . . . . 0.0 112.068 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -47.82 -40.6 21.56 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.442 HG21 ' HB2' ' A' ' 61' ' ' GLU . 60.6 mt -64.01 -47.13 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 C-N-CA 126.631 1.972 . . . . 0.0 111.79 171.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.67 HD13 HG23 ' B' ' 202' ' ' ILE . 3.2 mt -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 119.337 -2.102 . . . . 0.0 113.653 175.513 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -66.09 -23.59 66.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.212 2.205 . . . . 0.0 113.411 176.79 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -59.72 -33.17 71.29 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.671 1.988 . . . . 0.0 112.201 169.654 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -80.12 -58.91 2.93 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.81 -1.181 . . . . 0.0 111.73 164.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -22.05 66.64 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 -162.222 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.0 ttmm -52.65 -53.92 40.48 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 127.068 2.147 . . . . 0.0 114.636 167.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -77.11 -16.63 59.12 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.794 -1.191 . . . . 0.0 113.363 -178.058 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -69.24 -46.26 67.79 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.145 -1.597 . . . . 0.0 113.113 168.105 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.6 mt -73.92 -45.87 47.89 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.764 -1.21 . . . . 0.0 113.841 176.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -110.15 87.35 2.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.431 -1.418 . . . . 0.0 109.495 173.842 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -89.2 143.98 26.45 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-O 122.234 1.016 . . . . 0.0 110.142 179.119 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 45.6 mttp -99.59 14.34 30.34 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.936 1.294 . . . . 0.0 110.346 174.865 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -155.56 -111.94 0.4 Allowed Glycine 0 N--CA 1.43 -1.761 0 O-C-N 121.154 -0.966 . . . . 0.0 111.504 173.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.0 ptp180 -101.04 165.57 13.96 Favored Pre-proline 0 N--CA 1.431 -1.419 0 O-C-N 120.918 -1.342 . . . . 0.0 109.525 -178.38 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -66.43 113.46 2.7 Favored 'Trans proline' 0 C--N 1.3 -2.012 0 CA-C-N 122.461 1.915 . . . . 0.0 111.574 163.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -99.48 -163.26 1.02 Allowed 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 123.901 0.88 . . . . 0.0 108.899 -178.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -93.13 -111.99 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.15 -1.796 . . . . 0.0 106.15 160.816 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -161.51 124.33 1.3 Allowed Glycine 0 N--CA 1.43 -1.716 0 O-C-N 120.017 -1.677 . . . . 0.0 110.354 172.456 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . 0.285 13.1 ptt? 44.76 -113.16 0.33 Allowed 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 116.609 2.078 . . . . 0.0 116.609 157.125 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.3 m -120.37 122.1 40.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.939 1.296 . . . . 0.0 110.248 152.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -66.9 -24.35 66.1 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.211 -1.555 . . . . 0.0 113.314 178.352 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.6 pm0 -72.7 -17.3 61.64 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 119.585 -1.947 . . . . 0.0 115.4 170.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -83.52 -33.38 25.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 119.452 -2.03 . . . . 0.0 109.961 -174.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -65.46 -35.02 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.182 1.468 . . . . 0.0 110.956 -179.587 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -63.98 -53.98 41.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.977 2.111 . . . . 0.0 113.75 163.763 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -49.77 -46.13 50.37 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.543 1.937 . . . . 0.0 115.478 -178.031 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.449 ' HA ' HD22 ' A' ' 64' ' ' ASN . 5.0 mm-40 -73.42 -33.97 65.23 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.56 -1.337 . . . . 0.0 111.493 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.566 ' HA ' ' CD2' ' A' ' 65' ' ' LEU . 72.6 t -71.58 -28.63 31.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.487 0 CA-C-O 123.734 1.73 . . . . 0.0 113.318 178.004 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.25 -39.06 82.34 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.179 -1.575 . . . . 0.0 110.655 176.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.449 HD22 ' HA ' ' A' ' 61' ' ' GLU 0.262 0.0 OUTLIER -70.58 -37.72 73.99 Favored 'General case' 0 N--CA 1.43 -1.43 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.452 -173.393 . . . . . . . . 4 4 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' A' ' 62' ' ' VAL 0.281 0.0 OUTLIER -81.63 -19.01 42.67 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 125.138 1.375 . . . . 0.0 114.602 179.315 . . . . . . . . 4 4 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 4.2 m-30 -95.13 -0.36 53.49 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.6 1.56 . . . . 0.0 112.153 -175.925 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 33.2 ptt-85 -54.27 133.24 44.77 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 116.439 2.015 . . . . 0.0 116.439 -161.801 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 113.91 -45.15 1.36 Allowed Glycine 0 N--CA 1.429 -1.789 0 C-N-CA 124.606 1.098 . . . . 0.0 111.122 -164.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -103.76 90.43 3.64 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-O 123.025 1.393 . . . . 0.0 112.516 -170.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -80.27 -28.31 38.39 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.216 1.562 . . . . 0.0 115.216 -168.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -53.55 -43.57 68.54 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.606 1.962 . . . . 0.0 114.085 -178.359 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.4 mt -65.62 -36.74 84.58 Favored 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.695 1.236 . . . . 0.0 112.819 -175.621 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 76' ' ' PHE . 41.1 mt -81.2 -24.88 37.17 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.443 2.297 . . . . 0.0 113.863 177.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 11.6 t -63.5 -52.03 63.01 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 125.992 1.717 . . . . 0.0 111.133 174.116 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -69.81 -18.13 63.44 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.538 1.681 . . . . 0.0 115.538 170.239 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 73' ' ' LEU . 24.1 t80 -54.56 -24.7 22.13 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 121.621 2.009 . . . . 0.0 115.324 -179.33 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -57.3 -18.82 30.24 Favored Glycine 0 N--CA 1.43 -1.76 0 C-N-CA 127.821 2.629 . . . . 0.0 115.845 169.959 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -59.54 -32.15 70.06 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.425 -1.632 . . . . 0.0 114.539 171.234 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -89.05 -21.86 23.24 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 125.204 1.402 . . . . 0.0 112.703 -177.773 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 54.9 mt -100.82 156.46 35.14 Favored Pre-proline 0 N--CA 1.428 -1.528 0 O-C-N 120.142 -1.599 . . . . 0.0 112.47 -171.165 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -75.79 169.44 22.23 Favored 'Trans proline' 0 N--CA 1.433 -2.039 0 C-N-CA 122.398 2.065 . . . . 0.0 111.115 169.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 63.0 mt-10 -72.88 -77.49 0.1 Allowed 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 121.743 0.782 . . . . 0.0 111.91 -179.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -150.5 -120.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.18 -2.526 . . . . 0.0 104.18 177.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.07 58.57 1.29 Allowed 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.819 1.295 . . . . 0.0 110.55 162.944 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? . . . . . 0 C--O 1.26 1.635 0 C-N-CA 125.308 1.443 . . . . 0.0 108.403 173.555 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.49 -1.356 0 N-CA-C 116.538 2.051 . . . . 0.0 116.538 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 36.8 mtm180 -75.62 109.67 9.39 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.671 -1.893 . . . . 0.0 114.721 -172.049 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . 0.276 2.5 ttt 57.23 69.08 0.77 Allowed 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 117.993 2.59 . . . . 0.0 117.993 168.26 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -119.42 179.29 4.25 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.732 -1.23 . . . . 0.0 111.151 168.029 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.67 HG23 HD13 ' A' ' 35' ' ' LEU . 8.6 mm -57.2 -21.96 15.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 127.465 2.306 . . . . 0.0 114.37 -176.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 42.8 tt0 -39.69 -49.64 2.27 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 127.918 2.487 . . . . 0.0 115.319 164.279 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 34.7 mtp -65.09 -23.72 67.24 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.292 1.437 . . . . 0.0 114.612 -174.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 84.7 mt -67.57 -36.49 81.04 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.175 -1.578 . . . . 0.0 113.508 171.229 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 35' ' ' LEU . 17.6 mt -82.58 -17.16 45.83 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 121.149 -0.969 . . . . 0.0 111.291 -175.546 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -81.61 -53.26 6.39 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.242 1.017 . . . . 0.0 109.151 173.236 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . 0.436 ' HB3' HG21 ' A' ' 14' ' ' VAL . . . -55.97 -38.07 69.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.033 1.333 . . . . 0.0 114.068 177.165 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.85 -51.03 69.89 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.126 1.528 . . . . 0.0 115.126 174.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.31 -39.09 82.13 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.101 -0.999 . . . . 0.0 111.403 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -55.08 -53.4 56.35 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.664 1.986 . . . . 0.0 113.271 169.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 11.2 mt -69.5 -28.29 65.92 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.752 -1.843 . . . . 0.0 114.248 -178.892 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -64.77 -37.55 88.0 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.42 1.488 . . . . 0.0 112.324 170.092 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 72.9 mtp85 -73.31 -18.25 61.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.244 -1.535 . . . . 0.0 114.435 170.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -72.68 -24.61 61.04 Favored 'General case' 0 N--CA 1.431 -1.412 0 O-C-N 118.786 -2.446 . . . . 0.0 113.771 170.422 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.9 mm-40 -58.57 -31.05 67.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.327 -1.483 . . . . 0.0 113.864 175.481 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -70.79 -41.48 71.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 127.79 2.436 . . . . 0.0 112.584 175.728 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -78.27 -22.93 47.55 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.11 -1.619 . . . . 0.0 113.258 -176.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -73.99 -19.76 60.55 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.904 -1.123 . . . . 0.0 113.397 166.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.59 -29.6 66.05 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.028 -1.67 . . . . 0.0 114.436 -179.172 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 3.8 t-160 . . . . . 0 C--O 1.259 1.58 0 N-CA-C 118.722 2.86 . . . . 0.0 118.722 160.516 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 CA--C 1.49 -1.337 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . 0.26 69.4 m 83.59 96.0 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.217 2.607 . . . . 0.0 111.399 178.268 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -83.67 -69.93 0.6 Allowed 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.409 -0.807 . . . . 0.0 110.421 -176.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -101.01 101.41 12.18 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 124.231 1.967 . . . . 0.0 112.219 175.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 53.5 t -75.03 -44.6 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 C-N-CA 127.346 2.258 . . . . 0.0 109.012 176.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -64.21 -20.73 66.23 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.944 1.298 . . . . 0.0 113.641 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 46.3 t80 -61.44 -45.87 92.49 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.438 -0.789 . . . . 0.0 112.345 166.292 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.455 ' HA ' HG12 ' A' ' 11' ' ' ILE . 32.1 m-80 -79.63 -29.71 41.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.865 2.066 . . . . 0.0 110.697 -173.153 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -71.17 -25.89 62.74 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.659 -1.276 . . . . 0.0 112.727 170.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -46.9 67.22 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.955 -1.09 . . . . 0.0 111.337 166.345 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.3 mm -55.74 -50.75 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.872 1.669 . . . . 0.0 114.335 177.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.9 p -59.01 -24.47 62.82 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 114.897 1.443 . . . . 0.0 114.897 -174.54 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -72.05 -59.56 2.68 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.319 1.448 . . . . 0.0 111.79 170.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -58.44 -37.27 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 125.924 1.689 . . . . 0.0 113.619 -179.274 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -59.21 -44.65 92.26 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.88 -1.762 . . . . 0.0 115.704 169.786 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt -65.86 -38.28 88.42 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.16 -1.588 . . . . 0.0 112.683 175.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.475 HG23 ' CE2' ' A' ' 21' ' ' PHE . 10.4 mt -53.87 -53.48 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.425 0 C-N-CA 128.26 2.624 . . . . 0.0 113.024 169.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -61.39 -44.54 96.98 Favored 'General case' 0 N--CA 1.432 -1.373 0 C-N-CA 124.386 1.074 . . . . 0.0 113.102 175.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.2 m -63.57 -29.84 71.04 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -71.34 -63.17 1.17 Allowed 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.664 -1.898 . . . . 0.0 114.485 170.159 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.475 ' CE2' HG23 ' A' ' 17' ' ' ILE 0.311 0.5 OUTLIER -82.15 44.92 0.89 Allowed 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.615 1.709 . . . . 0.0 115.615 -170.84 . . . . . . . . 4 4 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 94.2 mt -71.15 -27.87 63.86 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.811 1.644 . . . . 0.0 110.419 170.808 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -85.19 -2.37 57.95 Favored 'General case' 0 N--CA 1.431 -1.411 0 CA-C-N 114.925 -1.034 . . . . 0.0 113.367 169.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -143.5 70.41 17.56 Favored Pre-proline 0 N--CA 1.43 -1.436 0 O-C-N 119.742 -1.849 . . . . 0.0 112.181 178.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.04 -6.06 18.3 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 123.606 2.871 . . . . 0.0 113.163 -175.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HG3' HD13 ' A' ' 27' ' ' ILE . 16.4 pt-20 -67.23 -23.73 65.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.424 1.489 . . . . 0.0 111.694 170.571 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.506 HG23 ' HB3' ' A' ' 65' ' ' LEU . 1.1 mm -67.98 -42.2 85.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 O-C-N 120.324 -1.485 . . . . 0.0 110.452 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -57.37 -33.91 68.3 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.849 1.259 . . . . 0.0 112.499 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -68.68 -57.38 5.77 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 121.051 -1.031 . . . . 0.0 111.528 172.021 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 55.6 m -64.98 -38.23 90.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.891 1.441 . . . . 0.0 114.891 -172.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -57.04 -59.69 4.7 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.35 2.26 . . . . 0.0 114.491 -176.591 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.68 -29.41 59.03 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.559 -1.338 . . . . 0.0 111.92 -170.035 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -48.49 -43.44 34.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.817 1.414 . . . . 0.0 114.817 167.966 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 71.5 mt -66.16 -47.22 85.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.538 1.535 . . . . 0.0 111.136 173.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' B' ' 206' ' ' LEU . 5.3 mt -65.78 -27.18 68.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 118.841 -2.412 . . . . 0.0 115.168 176.066 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -71.92 -26.52 62.34 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 119.166 -2.209 . . . . 0.0 112.607 171.681 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.47 -27.46 68.52 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.361 -1.462 . . . . 0.0 111.631 171.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.478 ' HB2' HG21 ' A' ' 58' ' ' VAL . 38.5 t80 -73.42 -58.37 3.36 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.688 -1.257 . . . . 0.0 112.072 164.327 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.76 -56.23 6.17 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 117.221 2.304 . . . . 0.0 117.221 -168.49 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 67.2 tttt -55.1 -45.33 75.46 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 127.219 2.208 . . . . 0.0 113.435 -174.352 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 38.4 mm-40 -71.31 -20.54 62.18 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.635 1.974 . . . . 0.0 112.679 179.778 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -90.32 -1.68 57.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.764 -1.21 . . . . 0.0 112.906 179.08 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.3 mt -80.23 -173.33 3.95 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.183 -1.573 . . . . 0.0 112.334 176.754 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.7 p80 -77.66 83.02 4.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.296 -1.503 . . . . 0.0 111.09 177.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.3 p -71.38 143.84 50.05 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.586 -1.322 . . . . 0.0 111.238 179.3 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.6 tttt -106.41 -29.89 9.45 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 123.971 0.908 . . . . 0.0 112.211 -163.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -108.05 -77.15 1.0 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 124.931 1.253 . . . . 0.0 111.467 176.073 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 12.5 ptp85 -68.75 158.11 86.71 Favored Pre-proline 0 N--CA 1.43 -1.463 0 C-N-CA 124.767 1.227 . . . . 0.0 113.317 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.84 154.1 58.67 Favored 'Trans proline' 0 N--CA 1.434 -2.002 0 CA-C-N 122.841 2.05 . . . . 0.0 112.625 176.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 35.8 p90 -79.2 162.41 25.75 Favored 'General case' 0 N--CA 1.429 -1.489 0 CA-C-O 122.544 1.164 . . . . 0.0 111.824 -177.581 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 68.4 mtm180 -139.23 -116.88 0.14 Allowed 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 -179.472 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.48 93.94 0.87 Allowed Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 108.204 -1.958 . . . . 0.0 108.204 -167.643 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -149.94 0.07 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -178.568 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.1 t -96.34 147.24 24.0 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 123.17 1.462 . . . . 0.0 111.868 -173.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.464 ' HB2' HD22 ' A' ' 80' ' ' LEU . 3.6 pm0 -56.62 -21.86 30.1 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.905 2.082 . . . . 0.0 114.31 170.632 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.66 -37.31 87.15 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 119.868 -1.77 . . . . 0.0 115.184 172.88 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -83.96 -34.5 24.41 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 123.956 1.836 . . . . 0.0 110.19 -173.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.478 HG21 ' HB2' ' A' ' 38' ' ' TYR . 0.3 OUTLIER -69.12 -31.22 49.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.409 0 CA-C-O 123.464 1.602 . . . . 0.0 110.48 -177.258 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -62.54 -58.73 6.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.859 1.663 . . . . 0.0 113.449 159.217 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . 0.263 0.4 OUTLIER -48.55 -47.52 39.33 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.901 2.481 . . . . 0.0 116.403 -177.125 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -78.11 -28.56 48.6 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.733 -1.229 . . . . 0.0 113.193 -174.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.5 ' HA ' HD13 ' A' ' 65' ' ' LEU . 88.9 t -72.58 -25.76 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 C-N-CA 126.006 1.722 . . . . 0.0 111.815 172.38 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -35.5 75.84 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.177 -1.577 . . . . 0.0 111.742 -174.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -71.36 -28.34 63.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 121.377 0.608 . . . . 0.0 112.478 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.506 ' HB3' HG23 ' A' ' 27' ' ' ILE . 6.1 mp -68.07 -37.51 81.35 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.265 1.426 . . . . 0.0 111.262 -179.037 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -96.86 5.81 49.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.155 1.382 . . . . 0.0 110.757 -169.196 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -67.27 123.61 20.82 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -163.946 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 124.81 -42.34 1.55 Allowed Glycine 0 N--CA 1.43 -1.708 0 N-CA-C 108.331 -1.908 . . . . 0.0 108.331 -167.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.06 125.67 39.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 123.817 0.847 . . . . 0.0 109.596 170.167 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -83.58 -38.51 21.55 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.725 -1.859 . . . . 0.0 114.581 164.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -64.4 -19.86 65.77 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -157.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.1 mt -73.19 -49.36 28.47 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.844 -1.16 . . . . 0.0 110.593 172.065 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.4 mt -73.94 -29.05 61.81 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.037 -1.665 . . . . 0.0 113.832 -174.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 49.2 m -57.36 -53.11 61.89 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 126.779 2.031 . . . . 0.0 110.992 172.411 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -71.8 -22.36 61.58 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.189 1.395 . . . . 0.0 113.711 174.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.403 ' CE1' HD11 ' B' ' 205' ' ' LEU . 1.1 t80 -61.46 -26.83 68.14 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 120.871 1.669 . . . . 0.0 113.008 177.54 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -62.66 -17.51 57.67 Favored Glycine 0 N--CA 1.43 -1.745 0 C-N-CA 127.613 2.53 . . . . 0.0 115.959 176.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -63.57 -35.76 81.55 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 118.943 1.371 . . . . 0.0 114.091 -170.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -132.02 22.03 4.52 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 123.337 0.655 . . . . 0.0 111.019 -176.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.464 HD22 ' HB2' ' A' ' 55' ' ' GLU 0.297 19.8 mt -69.75 -87.93 0.02 OUTLIER Pre-proline 0 N--CA 1.43 -1.457 0 CA-C-O 115.921 -1.99 . . . . 0.0 114.781 161.376 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -72.13 151.93 55.86 Favored 'Trans proline' 0 C--N 1.3 -2.006 0 CA-C-N 126.86 3.486 . . . . 0.0 113.402 -170.74 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -87.72 -36.17 17.52 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 124.783 1.233 . . . . 0.0 113.248 -169.479 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -148.6 -59.63 0.23 Allowed 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 -174.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -142.93 -44.74 0.3 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.492 1.664 . . . . 0.0 115.492 168.123 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 21.2 mtm180 . . . . . 0 C--O 1.26 1.655 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -172.371 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 CA--C 1.49 -1.35 0 N-CA-C 112.631 0.604 . . . . 0.0 112.631 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 11.6 mmp_? -105.83 145.8 30.73 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 124.627 1.171 . . . . 0.0 109.142 173.086 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -70.0 140.16 52.87 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 121.159 -0.963 . . . . 0.0 113.35 174.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -174.48 -168.67 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 103.852 -2.647 . . . . 0.0 103.852 -172.947 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 41.1 mm -52.69 -45.91 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 127.477 2.311 . . . . 0.0 112.837 174.305 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 12.9 tm0? -50.09 -39.17 41.76 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.563 2.345 . . . . 0.0 116.134 -176.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 13.4 mtp -72.76 -17.02 61.63 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 115.593 1.701 . . . . 0.0 115.593 179.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . 0.403 HD11 ' CE1' ' A' ' 76' ' ' PHE . 28.5 mt -69.4 -27.38 65.25 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 116.381 1.993 . . . . 0.0 116.381 -178.397 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.672 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -77.46 -25.14 50.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.702 1.201 . . . . 0.0 110.62 178.02 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -81.96 -40.92 21.53 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.761 1.224 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.92 96.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.663 1.585 . . . . 0.0 113.012 173.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.93 -50.67 70.1 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 124.749 1.22 . . . . 0.0 113.936 173.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.72 -39.07 90.8 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.284 1.216 . . . . 0.0 114.284 -176.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -58.28 -47.62 83.05 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.993 2.117 . . . . 0.0 112.505 170.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.13 -25.24 65.19 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.514 -1.366 . . . . 0.0 114.603 -178.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -65.45 -38.38 89.68 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.407 1.083 . . . . 0.0 112.496 170.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 89.6 mtt-85 -71.4 -37.09 71.55 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.816 -1.803 . . . . 0.0 113.981 176.255 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -53.58 -27.14 24.74 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 116.866 2.172 . . . . 0.0 116.866 174.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -61.47 -33.44 73.77 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.264 1.426 . . . . 0.0 113.745 173.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -78.0 -26.68 48.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.178 1.391 . . . . 0.0 111.363 -178.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 66.1 mt-10 -74.89 -35.1 62.28 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 119.715 -1.866 . . . . 0.0 112.083 177.339 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -71.06 -18.36 62.56 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.746 2.018 . . . . 0.0 114.172 175.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -68.76 -46.59 68.41 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 120.725 -1.235 . . . . 0.0 111.809 179.619 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . 0.265 57.2 m80 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 127.578 2.351 . . . . 0.0 114.299 174.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 CA--C 1.49 -1.361 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.0 m -87.45 113.3 23.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.712 1.244 . . . . 0.0 114.266 -158.862 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -83.94 -31.9 25.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 128.591 2.756 . . . . 0.0 113.064 -178.471 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -83.88 40.14 0.73 Allowed 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 116.094 1.887 . . . . 0.0 116.094 -169.337 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 59.5 t -63.28 -56.41 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 126.353 1.861 . . . . 0.0 112.494 -178.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -75.55 -18.67 59.71 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.517 -1.365 . . . . 0.0 114.066 -176.789 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -58.75 -48.48 81.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.47 -0.769 . . . . 0.0 111.295 161.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -73.55 -30.5 63.1 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.538 1.535 . . . . 0.0 111.449 -172.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -63.63 -33.22 75.14 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.117 1.367 . . . . 0.0 112.126 170.258 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.4 ' O ' HG23 ' A' ' 14' ' ' VAL . . . -69.41 -53.59 18.58 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.359 1.064 . . . . 0.0 111.8 169.038 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 mm -49.95 -49.38 21.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 126.721 2.008 . . . . 0.0 114.063 -179.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.2 m -59.43 -31.04 68.93 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.065 1.746 . . . . 0.0 114.127 -179.99 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.6 t80 -73.29 -50.77 20.41 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 124.486 1.115 . . . . 0.0 110.723 175.519 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 10' ' ' ALA . 2.5 t -57.25 -46.71 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 124.937 1.295 . . . . 0.0 112.702 177.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.9 t30 -56.79 -40.51 76.05 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.512 2.041 . . . . 0.0 116.512 170.714 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -62.65 -43.75 98.02 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.161 -2.212 . . . . 0.0 113.327 174.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.3 mt -59.04 -50.0 81.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 126.868 2.067 . . . . 0.0 111.872 172.966 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -55.37 -44.65 76.22 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.97 1.308 . . . . 0.0 113.367 174.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 23.6 m -57.47 -43.21 83.86 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 175.838 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 17.3 mmp_? -67.77 -48.59 65.93 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.03 -2.294 . . . . 0.0 113.504 173.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -89.45 43.9 1.18 Allowed 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.658 -1.276 . . . . 0.0 114.118 -176.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.9 mt -78.54 -32.58 47.96 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.168 1.387 . . . . 0.0 111.17 168.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -77.81 -16.42 58.35 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.019 1.328 . . . . 0.0 110.538 176.113 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 58.1 m80 -138.17 71.78 46.87 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 120.025 -1.672 . . . . 0.0 111.412 -173.721 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -74.1 -12.61 23.55 Favored 'Trans proline' 0 N--CA 1.434 -2.008 0 C-N-CA 123.143 2.562 . . . . 0.0 112.687 -172.164 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -70.61 -18.71 62.88 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.331 1.452 . . . . 0.0 111.923 175.082 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.45 ' N ' HD13 ' A' ' 27' ' ' ILE . 0.7 OUTLIER -68.71 -52.67 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 170.147 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 22.7 t80 -62.15 -26.28 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -175.554 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -60.14 3.72 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.529 -1.357 . . . . 0.0 113.591 164.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 69.9 m -80.48 -24.95 39.1 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.31 -1.494 . . . . 0.0 114.764 -170.088 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -46.67 -56.98 5.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.072 2.549 . . . . 0.0 113.755 171.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 1.8 mt -72.5 -35.47 68.16 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.648 -1.282 . . . . 0.0 111.487 -176.794 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -50.03 -41.02 46.65 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 116.601 2.075 . . . . 0.0 116.601 170.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 80.4 mt -59.34 -48.13 88.11 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.399 -1.438 . . . . 0.0 112.169 168.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HD11 ' B' ' 206' ' ' LEU . 2.1 mt -64.71 -39.19 93.23 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 119.389 -2.069 . . . . 0.0 114.774 175.605 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.402 ' CE1' HD12 ' B' ' 206' ' ' LEU . 87.9 m-70 -55.36 -40.67 71.55 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 127.035 2.134 . . . . 0.0 112.549 172.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.92 -35.47 33.37 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.797 1.639 . . . . 0.0 114.423 174.493 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.429 ' HB2' ' CE ' ' A' ' 53' ' ' MET . 0.1 OUTLIER -82.26 -53.7 5.84 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.504 -1.373 . . . . 0.0 113.614 165.935 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' B' ' 206' ' ' LEU . 2.0 tm0? -65.49 -30.43 71.2 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 116.782 2.142 . . . . 0.0 116.782 -167.71 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.0 mmtt -60.29 -55.61 31.57 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.23 1.812 . . . . 0.0 112.672 172.661 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -58.81 -35.66 73.22 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.672 1.189 . . . . 0.0 114.163 178.406 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.34 -26.86 68.22 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.53 1.932 . . . . 0.0 115.146 174.657 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 71.3 mt -81.94 149.55 28.15 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 119.511 -1.993 . . . . 0.0 113.594 179.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 18.2 m-70 74.63 42.08 0.31 Allowed 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 126.613 1.965 . . . . 0.0 113.536 169.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.2 p -80.12 163.59 24.0 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.09 -1.006 . . . . 0.0 111.224 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -76.94 -1.67 29.78 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.242 -1.536 . . . . 0.0 114.329 175.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 161.12 -63.57 0.28 Allowed Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.813 -1.18 . . . . 0.0 111.679 175.377 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 28.3 ptt-85 -72.26 155.88 91.08 Favored Pre-proline 0 N--CA 1.43 -1.458 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 -170.935 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -74.51 112.95 3.67 Favored 'Trans proline' 0 N--CA 1.434 -2.029 0 C-N-CA 122.63 2.22 . . . . 0.0 111.789 168.268 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -153.48 158.67 41.69 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 104.863 -2.273 . . . . 0.0 104.863 -178.707 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . 0.317 87.5 mtt-85 85.65 126.87 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 124.764 2.221 . . . . 0.0 116.06 168.148 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 132.16 138.82 4.21 Favored Glycine 0 N--CA 1.43 -1.724 0 N-CA-C 104.357 -3.497 . . . . 0.0 104.357 -170.716 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.429 ' CE ' ' HB2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -80.82 -161.58 0.4 Allowed 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 121.116 -1.226 . . . . 0.0 110.14 174.571 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 60.5 m -66.7 130.6 43.71 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.701 -1.874 . . . . 0.0 113.063 -175.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' HB2' HD22 ' A' ' 80' ' ' LEU . 3.5 pm0 -61.53 -19.8 62.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.77 1.628 . . . . 0.0 112.298 169.165 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -62.07 -38.6 89.41 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 162.475 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -83.91 -33.06 24.82 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.247 -2.158 . . . . 0.0 110.211 -171.332 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.02 -35.73 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 123.209 1.481 . . . . 0.0 111.016 179.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -65.53 -54.57 26.24 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 128.471 2.708 . . . . 0.0 113.451 163.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -54.11 -46.96 72.27 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.239 1.816 . . . . 0.0 115.494 -179.409 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.536 ' O ' HD12 ' A' ' 65' ' ' LEU 0.311 10.1 mt-10 -70.16 -44.12 69.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.144 -1.597 . . . . 0.0 110.907 -175.657 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 37.6 t -49.98 -38.91 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 C-N-CA 127.166 2.186 . . . . 0.0 115.137 172.018 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.46 -30.75 70.55 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.532 1.933 . . . . 0.0 111.618 -177.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . 0.336 0.1 OUTLIER -79.2 -23.68 43.65 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.277 -0.889 . . . . 0.0 111.969 -177.893 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.536 HD12 ' O ' ' A' ' 61' ' ' GLU . 3.4 mp -75.54 -29.7 59.51 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 165.901 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 11.3 m-30 -96.67 -1.17 47.19 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.355 -1.466 . . . . 0.0 111.813 -167.794 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.6 ptt180 -34.4 119.9 0.44 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 130.893 3.677 . . . . 0.0 118.351 -169.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.13 -7.3 54.49 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.854 -1.779 . . . . 0.0 112.639 -177.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -122.06 87.55 2.77 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 122.971 1.367 . . . . 0.0 109.884 177.597 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.0 -19.6 47.42 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.534 1.134 . . . . 0.0 113.275 -173.149 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -47.36 -42.8 22.35 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 129.572 3.149 . . . . 0.0 112.826 176.26 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 54.9 mt -70.17 -49.23 52.54 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 124.619 1.167 . . . . 0.0 113.026 179.363 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.61 -23.16 63.48 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.887 -1.758 . . . . 0.0 112.957 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 59.0 m -66.1 -50.41 64.17 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.935 1.294 . . . . 0.0 111.88 176.541 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -70.46 -19.3 62.97 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 170.239 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.25 -22.89 67.16 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.478 -1.389 . . . . 0.0 113.228 178.32 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.93 -18.14 61.76 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.566 1.555 . . . . 0.0 115.426 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -76.28 -17.94 59.22 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.723 -2.046 . . . . 0.0 112.863 176.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -86.72 -7.29 58.41 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 125.029 1.332 . . . . 0.0 110.612 172.017 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.41 HD22 ' HB2' ' A' ' 55' ' ' GLU . 52.4 mt -112.06 175.1 2.0 Allowed Pre-proline 0 N--CA 1.431 -1.417 0 C-N-CA 124.873 1.269 . . . . 0.0 110.558 176.801 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -65.83 -63.68 0.06 OUTLIER 'Trans proline' 0 N--CA 1.434 -1.973 0 C-N-CA 122.302 2.001 . . . . 0.0 114.709 167.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -110.95 -121.59 0.28 Allowed 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.388 1.075 . . . . 0.0 110.627 -178.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -167.47 -36.19 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.272 -1.518 . . . . 0.0 111.461 -173.368 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . 0.271 3.4 mptp? 79.52 -0.43 2.21 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 127.425 2.29 . . . . 0.0 114.945 -179.319 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . 0.302 0.0 OUTLIER . . . . . 0 C--O 1.26 1.618 0 C-N-CA 128.028 2.531 . . . . 0.0 114.768 -177.478 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 CA--C 1.49 -1.328 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 34.5 mtm105 -141.45 166.92 23.43 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.247 -1.533 . . . . 0.0 112.603 -168.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 8.3 mmm -63.66 115.01 4.34 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.18 1.392 . . . . 0.0 113.867 178.248 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -127.8 174.73 8.88 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 170.248 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 11.8 mm -57.62 -30.53 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 125.619 1.567 . . . . 0.0 112.56 173.616 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -41.87 -36.28 1.02 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.367 2.667 . . . . 0.0 117.102 168.653 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 85.2 mmm -58.05 -36.83 73.33 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.662 1.185 . . . . 0.0 114.132 -177.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 6.5 mp -64.07 -35.37 80.52 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 118.753 2.872 . . . . 0.0 118.753 -175.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.606 HD11 ' HB2' ' A' ' 35' ' ' LEU . 2.2 mm? -74.8 -23.3 58.46 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-O 122.353 1.073 . . . . 0.0 110.877 178.528 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 92.3 mt-10 -81.91 -45.93 14.77 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.417 -0.802 . . . . 0.0 110.434 176.143 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -58.83 -43.42 90.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.412 1.485 . . . . 0.0 113.501 175.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -55.26 -53.25 58.47 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 173.228 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -71.78 -29.78 64.85 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.97 -1.081 . . . . 0.0 113.308 -178.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -62.54 -46.86 86.44 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 126.081 1.753 . . . . 0.0 112.203 169.386 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 38.8 tp -78.16 -24.08 47.44 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 119.995 -1.691 . . . . 0.0 111.893 -174.195 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.62 -35.98 73.34 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.933 2.093 . . . . 0.0 113.021 167.131 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 86.0 mtt-85 -63.58 -28.8 70.18 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.759 -1.213 . . . . 0.0 113.729 174.882 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 47.8 mtp180 -70.38 -41.54 72.93 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 121.016 -1.052 . . . . 0.0 112.048 174.169 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -64.95 -41.24 95.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.651 1.18 . . . . 0.0 113.634 173.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -64.11 -36.89 85.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.532 -1.355 . . . . 0.0 113.808 177.567 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.87 -42.11 97.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 113.812 1.042 . . . . 0.0 113.812 169.957 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -63.6 -20.25 65.5 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.54 1.682 . . . . 0.0 115.54 179.447 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -71.08 -57.84 4.14 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 121.19 -0.944 . . . . 0.0 112.183 170.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 29.1 m170 . . . . . 0 C--O 1.26 1.628 0 C-N-CA 126.311 1.844 . . . . 0.0 114.424 -169.19 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 120.793 0.33 . . . . 0.0 110.371 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 p -158.53 134.74 9.23 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.742 -1.224 . . . . 0.0 110.407 170.629 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -90.73 -47.68 7.5 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 121.279 -0.888 . . . . 0.0 110.133 169.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.4 m 68.78 66.98 0.3 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 123.838 1.78 . . . . 0.0 112.479 176.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 97.3 t -67.9 -51.4 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 129.262 3.025 . . . . 0.0 110.87 -175.125 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -64.79 -25.73 68.05 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.536 -1.352 . . . . 0.0 113.565 178.723 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -65.71 -39.2 90.97 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.083 0.953 . . . . 0.0 110.657 172.972 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.487 ' HA ' HG12 ' A' ' 11' ' ' ILE . 92.7 m-20 -75.21 -22.95 57.59 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.435 1.894 . . . . 0.0 111.197 -178.268 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -74.15 -29.07 61.62 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.117 -0.989 . . . . 0.0 111.717 171.043 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.17 -42.62 75.66 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.841 -1.162 . . . . 0.0 111.476 169.036 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.487 HG12 ' HA ' ' A' ' 8' ' ' ASN . 12.6 mm -56.9 -50.26 76.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 C-N-CA 125.136 1.374 . . . . 0.0 113.581 174.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.7 p -61.04 -34.74 75.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 -178.106 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -65.96 -49.66 67.08 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.128 -0.983 . . . . 0.0 112.64 172.48 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 46.6 t -58.65 -43.73 88.16 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 125.673 1.589 . . . . 0.0 112.685 175.488 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -53.31 -43.91 67.94 Favored 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 116.087 1.884 . . . . 0.0 116.087 168.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -60.49 -46.6 89.5 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.231 -1.543 . . . . 0.0 111.596 173.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 92.6 mt -60.49 -44.02 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 C-N-CA 126.149 1.78 . . . . 0.0 113.03 177.762 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.7 mtmt -55.8 -47.86 76.39 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.419 -1.425 . . . . 0.0 113.459 172.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -72.73 -23.33 60.83 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.764 1.226 . . . . 0.0 113.062 -178.446 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 23.2 mmt85 -82.19 -42.02 19.56 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.488 -2.007 . . . . 0.0 114.879 169.205 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 15.3 m-30 -83.81 48.53 1.46 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.753 -1.842 . . . . 0.0 113.251 -178.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.6 mt -78.58 -37.55 42.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.022 1.329 . . . . 0.0 110.284 167.826 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -72.7 -17.38 61.64 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 121.04 -1.038 . . . . 0.0 113.622 170.65 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -130.1 64.46 72.53 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -166.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -70.59 -22.1 28.74 Favored 'Trans proline' 0 C--N 1.3 -2.007 0 C-N-CA 122.814 2.343 . . . . 0.0 113.653 -178.061 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.1 pm0 -64.55 -34.33 77.99 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 120.137 1.335 . . . . 0.0 113.816 177.363 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.409 HG23 HD23 ' A' ' 65' ' ' LEU . 19.0 mt -70.85 -23.08 23.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.639 1.976 . . . . 0.0 112.0 -177.392 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -62.25 -23.7 66.83 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.146 -0.971 . . . . 0.0 112.958 177.134 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 29.4 mmm-85 -79.82 -51.96 8.51 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.783 -1.198 . . . . 0.0 113.464 164.313 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.7 m -74.8 -32.93 62.14 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 -164.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -51.71 -57.21 9.88 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.077 1.351 . . . . 0.0 113.844 170.745 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 0.7 OUTLIER -68.9 -36.44 78.03 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 120.888 -1.132 . . . . 0.0 112.195 -175.573 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -49.76 -33.72 17.11 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 116.85 2.167 . . . . 0.0 116.85 170.32 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 77.9 mt -72.29 -42.38 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.442 0 O-C-N 119.542 -1.973 . . . . 0.0 110.729 171.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HB2' HD21 ' B' ' 206' ' ' LEU . 3.9 mt -66.93 -26.17 66.71 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.11 -2.244 . . . . 0.0 113.412 175.695 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -75.25 -26.82 59.14 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.706 -1.871 . . . . 0.0 112.789 173.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.05 -35.47 75.19 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.635 1.974 . . . . 0.0 111.499 167.604 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.553 ' HB2' ' HE2' ' A' ' 53' ' ' MET . 2.9 t80 -70.94 -62.56 1.35 Allowed 'General case' 0 N--CA 1.429 -1.508 0 O-C-N 120.741 -1.224 . . . . 0.0 111.396 167.816 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.98 -19.52 65.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -158.142 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -45.3 -31.71 1.69 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.331 2.652 . . . . 0.0 115.823 166.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -44.02 33.99 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.444 2.298 . . . . 0.0 116.23 174.129 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -82.77 -30.73 28.73 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 121.975 0.893 . . . . 0.0 112.0 -177.852 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 89.1 mt -71.07 -25.52 62.66 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -172.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -65.25 -76.24 0.08 Allowed 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.975 -1.078 . . . . 0.0 111.722 168.191 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.2 t -176.1 154.2 1.39 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 124.704 1.201 . . . . 0.0 108.165 -176.067 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -99.76 170.08 8.8 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.298 1.439 . . . . 0.0 111.225 179.393 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.43 -27.85 14.25 Favored Glycine 0 N--CA 1.429 -1.771 0 O-C-N 119.955 -1.716 . . . . 0.0 113.507 170.366 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -89.23 164.54 30.01 Favored Pre-proline 0 N--CA 1.43 -1.445 0 C-N-CA 125.611 1.564 . . . . 0.0 111.789 -177.851 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_exo -59.18 133.39 52.57 Favored 'Trans proline' 0 N--CA 1.433 -2.043 0 C-N-CA 123.241 2.628 . . . . 0.0 114.754 178.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.02 136.24 35.51 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 117.559 2.429 . . . . 0.0 117.559 -161.822 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 16.3 mmt-85 -99.82 -21.66 15.65 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.469 1.508 . . . . 0.0 111.615 176.265 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.09 50.78 3.11 Favored Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 115.896 1.118 . . . . 0.0 115.896 -178.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.553 ' HE2' ' HB2' ' A' ' 38' ' ' TYR . 23.6 ptt? 33.73 -137.28 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 130.513 3.525 . . . . 0.0 118.785 155.808 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 19.8 m -106.25 131.49 53.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.487 1.115 . . . . 0.0 109.871 169.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -59.14 -35.72 73.97 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.033 1.733 . . . . 0.0 111.529 172.863 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -62.73 -21.88 66.13 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.886 1.81 . . . . 0.0 115.886 174.261 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -84.33 -34.77 23.6 Favored 'General case' 0 N--CA 1.429 -1.497 0 CA-C-N 121.107 1.776 . . . . 0.0 110.176 -171.255 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -67.94 -35.49 72.22 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 CA-C-O 123.137 1.446 . . . . 0.0 109.651 -177.249 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -61.32 -53.67 53.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 128.705 2.802 . . . . 0.0 113.626 163.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.76 -42.19 75.1 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.633 1.973 . . . . 0.0 115.964 -178.703 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 -72.26 -45.51 59.83 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.593 -1.317 . . . . 0.0 111.195 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 35' ' ' LEU . 46.7 t -54.36 -31.38 22.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.949 2.1 . . . . 0.0 114.446 173.15 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.92 -32.16 73.39 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.208 1.803 . . . . 0.0 112.056 -175.572 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -75.87 -30.17 58.77 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 121.8 -0.562 . . . . 0.0 111.93 179.435 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD23 HG23 ' A' ' 27' ' ' ILE . 6.9 mp -73.01 -34.43 66.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.327 1.451 . . . . 0.0 110.268 -178.986 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -91.33 -11.61 37.44 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.705 2.002 . . . . 0.0 111.652 -170.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -42.8 131.31 4.09 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 128.647 2.779 . . . . 0.0 117.108 -166.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 102.63 -30.63 10.01 Favored Glycine 0 N--CA 1.43 -1.735 0 CA-C-N 114.351 -1.295 . . . . 0.0 111.246 -171.046 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -100.98 84.12 2.63 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-O 123.953 1.835 . . . . 0.0 111.167 -179.535 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -77.05 -31.94 56.52 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.674 1.99 . . . . 0.0 111.404 -169.048 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -67.81 -23.18 65.16 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 125.402 1.481 . . . . 0.0 113.55 -178.373 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.77 -49.84 60.28 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.404 -1.435 . . . . 0.0 111.992 172.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.9 -28.02 67.15 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.222 -1.549 . . . . 0.0 113.127 -178.866 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 72.7 m -63.4 -51.49 65.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 124.718 1.207 . . . . 0.0 111.589 176.356 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 58.8 mt-10 -75.46 -17.99 59.99 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.716 -1.24 . . . . 0.0 113.504 176.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -61.91 -22.98 66.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.59 -1.319 . . . . 0.0 113.559 170.136 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.33 -18.97 61.49 Favored Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 126.363 1.935 . . . . 0.0 115.164 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -72.91 -23.97 60.77 Favored 'General case' 0 N--CA 1.431 -1.416 0 CA-C-N 119.678 1.739 . . . . 0.0 113.013 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -81.57 -30.45 33.04 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.127 1.371 . . . . 0.0 110.772 179.133 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.8 mt -84.43 150.02 56.22 Favored Pre-proline 0 N--CA 1.43 -1.454 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -177.637 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -77.68 147.67 25.05 Favored 'Trans proline' 0 C--N 1.299 -2.055 0 C-N-CA 122.418 2.079 . . . . 0.0 112.667 175.937 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.5 pp20? -77.3 -46.11 24.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 176.372 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -164.52 -60.7 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 175.492 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -163.39 71.56 0.26 Allowed 'General case' 0 N--CA 1.43 -1.471 0 CA-C-O 122.176 0.989 . . . . 0.0 110.715 175.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.604 0 C-N-CA 124.453 1.101 . . . . 0.0 113.669 -176.348 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.49 -1.345 0 CA-C-O 122.062 0.934 . . . . 0.0 113.23 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 67.7 mtt-85 -142.82 -171.06 3.37 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.742 -1.849 . . . . 0.0 109.209 174.152 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 9.0 mtt -73.48 -107.4 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.605 -1.31 . . . . 0.0 112.44 167.008 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 71.7 178.21 0.25 Allowed 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 127.792 2.437 . . . . 0.0 110.943 -168.995 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . . . . . . . . . 7.3 mt -74.24 -20.13 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 119.157 -2.214 . . . . 0.0 113.788 178.295 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -51.67 -27.42 11.5 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 176.73 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 28.3 mmm -71.74 -31.14 66.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 126.128 1.771 . . . . 0.0 114.113 179.244 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 16.9 mt -57.29 -37.19 72.04 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.443 -1.411 . . . . 0.0 114.531 176.465 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.423 HD21 ' HB2' ' A' ' 35' ' ' LEU . 6.5 mt -81.31 -18.06 47.08 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-O 122.37 1.081 . . . . 0.0 109.345 -171.812 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.26 -48.98 10.59 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.01 0.924 . . . . 0.0 110.506 171.533 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.43 -43.36 83.78 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.339 1.856 . . . . 0.0 114.658 177.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -61.28 -43.47 98.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 124.745 1.218 . . . . 0.0 113.904 173.529 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -67.07 -44.18 80.75 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 124.74 1.216 . . . . 0.0 112.369 177.691 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -53.89 -52.89 59.05 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.78 2.032 . . . . 0.0 113.188 171.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 6.7 mt -68.76 -24.93 64.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.23 -1.543 . . . . 0.0 114.368 -179.843 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -71.1 -45.94 62.71 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.401 1.481 . . . . 0.0 111.787 171.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 46.3 ttt-85 -59.61 -35.75 74.96 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.984 2.114 . . . . 0.0 114.734 172.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 16.9 mmm180 -53.27 -34.07 55.71 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 126.351 1.86 . . . . 0.0 115.326 174.638 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -69.05 -29.91 68.15 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 114.227 1.195 . . . . 0.0 114.227 179.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -80.08 -39.36 29.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 125.408 1.483 . . . . 0.0 110.252 172.698 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -58.1 -46.8 84.92 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 125.731 1.612 . . . . 0.0 114.895 176.559 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -58.74 -19.18 37.97 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 127.606 2.362 . . . . 0.0 116.795 179.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -67.79 -35.73 79.17 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.066 -1.021 . . . . 0.0 113.309 177.453 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 15.9 p-80 . . . . . 0 C--O 1.26 1.654 0 C-N-CA 124.445 1.098 . . . . 0.0 111.707 -174.447 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 . . . . . 0 CA--C 1.49 -1.355 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 74.64 139.76 0.06 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.389 2.276 . . . . 0.0 114.785 169.929 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -90.29 112.76 24.43 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.271 -1.518 . . . . 0.0 109.522 176.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -132.7 34.22 3.68 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.139 1.376 . . . . 0.0 109.855 -174.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.6 t -56.72 -55.83 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 128.61 2.764 . . . . 0.0 112.264 -179.499 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -76.74 -20.08 56.92 Favored 'General case' 0 N--CA 1.43 -1.468 0 CA-C-O 122.646 1.213 . . . . 0.0 112.546 -171.437 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.97 -40.73 96.58 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.658 165.945 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.496 ' HA ' HG12 ' A' ' 11' ' ' ILE . 13.6 m-80 -77.88 -28.83 50.03 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.767 2.427 . . . . 0.0 112.225 178.578 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -63.54 -32.32 73.74 Favored 'General case' 0 N--CA 1.431 -1.403 0 O-C-N 120.586 -1.321 . . . . 0.0 112.041 169.142 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.94 -42.85 72.69 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.728 -1.232 . . . . 0.0 112.731 170.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.496 HG12 ' HA ' ' A' ' 8' ' ' ASN . 20.7 mm -57.25 -48.69 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.328 1.451 . . . . 0.0 113.569 177.773 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.3 p -55.2 -36.0 65.45 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.247 1.019 . . . . 0.0 113.415 -178.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.7 t80 -69.01 -54.66 14.0 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 123.62 0.768 . . . . 0.0 112.123 178.913 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.0 t -59.79 -40.11 81.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.476 0 O-C-N 120.691 -1.256 . . . . 0.0 112.673 177.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -59.0 -49.09 79.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 170.796 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -58.29 -39.92 80.58 Favored 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 120.646 1.566 . . . . 0.0 113.827 175.468 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -59.01 -49.03 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 C-N-CA 125.825 1.65 . . . . 0.0 111.566 173.769 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -64.6 -39.23 93.35 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.964 1.306 . . . . 0.0 113.618 179.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 26.5 m -62.09 -39.73 93.44 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.198 1.399 . . . . 0.0 113.99 173.383 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -72.1 -43.25 65.07 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.522 -1.986 . . . . 0.0 113.557 171.546 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.3 m-85 -85.14 47.76 1.46 Allowed 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.907 -1.746 . . . . 0.0 114.156 -177.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.5 mt -82.61 -38.87 22.98 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.567 -1.333 . . . . 0.0 110.107 167.545 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -77.7 -4.61 47.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 124.901 1.28 . . . . 0.0 113.115 173.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 60.3 m80 -141.02 69.45 28.66 Favored Pre-proline 0 CA--C 1.488 -1.406 0 O-C-N 120.336 -1.477 . . . . 0.0 110.366 177.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -75.58 -4.99 16.02 Favored 'Trans proline' 0 N--CA 1.433 -2.048 0 CA-C-N 123.786 2.388 . . . . 0.0 113.434 -170.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -79.33 -19.56 50.03 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.099 1.36 . . . . 0.0 111.579 -176.662 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.432 ' N ' HD13 ' A' ' 27' ' ' ILE . 1.1 mm -67.43 -33.4 62.22 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 O-C-N 120.281 -1.512 . . . . 0.0 110.239 177.532 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -64.64 -19.57 65.78 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.379 1.472 . . . . 0.0 113.634 -179.453 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -60.28 2.4 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.385 -2.072 . . . . 0.0 111.795 163.277 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 4.7 t -79.96 -25.58 40.34 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.286 -1.509 . . . . 0.0 114.406 -160.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -53.52 -54.92 30.32 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 120.218 -1.551 . . . . 0.0 114.747 170.447 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 5.2 mt -70.95 -37.44 72.82 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.363 1.065 . . . . 0.0 111.999 -174.307 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -45.2 -46.54 12.32 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 168.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 86.3 mt -63.3 -44.25 99.03 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.497 0 O-C-N 120.463 -1.398 . . . . 0.0 112.152 174.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.684 HD13 HG23 ' B' ' 202' ' ' ILE . 1.5 mt -62.32 -38.87 91.1 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.525 -1.984 . . . . 0.0 114.325 174.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -61.37 -33.54 73.81 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.76 1.224 . . . . 0.0 112.726 175.117 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -55.75 -26.61 46.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.064 1.346 . . . . 0.0 114.449 173.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -59.52 2.68 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.35 -1.469 . . . . 0.0 113.187 162.96 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.805 ' HG2' HD12 ' B' ' 206' ' ' LEU 0.319 0.0 OUTLIER -77.6 -15.9 58.93 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 116.282 1.956 . . . . 0.0 116.282 -160.306 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -38.98 -39.46 0.54 Allowed 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 129.806 3.242 . . . . 0.0 118.345 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.89 -28.39 16.01 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 128.366 2.667 . . . . 0.0 115.639 176.342 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -81.16 -21.7 39.55 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.9 mt -60.66 -45.9 92.36 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -173.282 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.55 60.5 1.01 Allowed 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.551 -1.343 . . . . 0.0 110.259 164.503 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 11.5 t -81.14 145.82 30.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.028 -1.045 . . . . 0.0 110.968 172.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -132.04 -110.8 0.24 Allowed 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 178.241 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -101.82 31.59 8.5 Favored Glycine 0 N--CA 1.43 -1.723 0 O-C-N 120.745 -1.222 . . . . 0.0 113.313 -178.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -84.8 154.08 61.14 Favored Pre-proline 0 N--CA 1.429 -1.482 0 O-C-N 121.525 -0.985 . . . . 0.0 109.822 174.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.76 169.45 22.34 Favored 'Trans proline' 0 C--N 1.3 -2.018 0 C-N-CA 121.894 1.729 . . . . 0.0 111.05 161.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -72.84 135.69 45.22 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 122.046 0.927 . . . . 0.0 111.73 178.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 6.8 mmp_? -100.09 -104.83 0.23 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 123.769 0.828 . . . . 0.0 112.867 178.067 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 69.51 -155.33 53.37 Favored Glycine 0 N--CA 1.431 -1.668 0 O-C-N 119.769 -1.832 . . . . 0.0 111.531 -168.052 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.3 ptt? -156.53 -138.55 0.07 Allowed 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 121.245 -1.15 . . . . 0.0 109.363 -164.772 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 56.8 m -86.92 122.14 30.37 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 162.544 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -59.35 -27.86 66.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.165 -1.584 . . . . 0.0 112.683 173.712 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -58.25 -28.81 65.26 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 168.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.43 -34.57 25.43 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.961 -1.712 . . . . 0.0 109.732 -169.16 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.61 -42.18 94.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 123.411 1.577 . . . . 0.0 109.738 179.808 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -59.8 -52.64 64.6 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 128.077 2.551 . . . . 0.0 113.444 167.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -55.38 -43.77 75.46 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.981 1.712 . . . . 0.0 115.263 -179.081 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 3.9 mt-10 -73.14 -43.4 61.64 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.62 -1.3 . . . . 0.0 112.879 -179.03 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.444 ' HA ' HD13 ' A' ' 65' ' ' LEU . 38.9 t -55.06 -32.48 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 C-N-CA 126.283 1.833 . . . . 0.0 114.394 172.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.06 -32.04 73.56 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 124.754 1.221 . . . . 0.0 111.682 -174.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -72.33 -28.27 62.95 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 121.23 -0.919 . . . . 0.0 112.152 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.444 HD13 ' HA ' ' A' ' 62' ' ' VAL . 6.3 mp -71.32 -41.86 69.34 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-O 122.847 1.308 . . . . 0.0 109.801 178.494 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 -92.62 -18.22 23.34 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.445 1.498 . . . . 0.0 111.754 -166.186 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -35.94 124.5 0.73 Allowed 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 130.296 3.439 . . . . 0.0 116.036 -176.681 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 118.09 -49.41 0.87 Allowed Glycine 0 N--CA 1.43 -1.736 0 N-CA-C 108.174 -1.971 . . . . 0.0 108.174 -165.068 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -94.96 102.28 14.09 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.664 -0.903 . . . . 0.0 112.024 -178.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -82.0 -26.35 33.93 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.271 -1.518 . . . . 0.0 113.333 175.489 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -68.78 -22.26 64.29 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 125.234 1.414 . . . . 0.0 113.903 -167.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 72.5 mt -74.08 -56.93 4.33 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.794 1.238 . . . . 0.0 112.502 169.714 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.02 -22.55 65.8 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.083 1.753 . . . . 0.0 113.483 -177.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 17.9 t -58.05 -54.52 46.01 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 128.741 2.817 . . . . 0.0 112.083 175.48 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -80.72 -23.37 39.52 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.03 1.732 . . . . 0.0 113.539 177.21 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -57.44 -22.29 42.46 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.387 1.475 . . . . 0.0 114.511 178.446 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -56.84 -19.83 30.73 Favored Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 127.111 2.291 . . . . 0.0 115.484 171.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -65.66 -29.31 69.85 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 116.328 1.973 . . . . 0.0 116.328 172.649 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -83.33 -23.37 32.57 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.95 -1.094 . . . . 0.0 111.422 178.859 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 81.3 mt -95.42 162.23 25.23 Favored Pre-proline 0 N--CA 1.43 -1.446 0 C-N-CA 124.074 0.949 . . . . 0.0 111.768 -177.276 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -72.43 162.37 41.66 Favored 'Trans proline' 0 N--CA 1.433 -2.037 0 CA-C-N 122.633 1.976 . . . . 0.0 114.186 -174.902 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -91.51 -39.11 12.12 Favored 'General case' 0 N--CA 1.429 -1.515 0 O-C-N 121.371 -0.831 . . . . 0.0 111.795 164.013 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -151.05 -123.6 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 176.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -121.23 -82.48 0.65 Allowed 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 153.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 50.3 mtt-85 . . . . . 0 C--O 1.259 1.603 0 C-N-CA 124.733 1.213 . . . . 0.0 110.024 171.318 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 198' ' ' VAL . . . . . . . . . . . . 0.26 14.6 p . . . . . 0 CA--C 1.49 -1.355 0 CA-C-O 123.283 1.516 . . . . 0.0 112.635 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 199' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -85.9 162.34 18.63 Favored 'General case' 0 N--CA 1.43 -1.448 0 O-C-N 119.605 -1.934 . . . . 0.0 111.637 178.154 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 200' ' ' MET . . . . . . . . . . . . . 34.8 mmm -75.3 75.78 2.41 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 120.57 -1.332 . . . . 0.0 113.709 176.816 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 201' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -111.37 176.07 5.17 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.218 1.407 . . . . 0.0 107.8 169.81 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 202' ' ' ILE . . . . . 0.684 HG23 HD13 ' A' ' 35' ' ' LEU . 6.1 mm -62.49 -28.57 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 O-C-N 119.783 -1.823 . . . . 0.0 113.449 179.694 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 203' ' ' GLN . . . . . . . . . . . . . 5.3 tt0 -41.27 -40.47 1.64 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 127.084 2.154 . . . . 0.0 115.887 170.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 204' ' ' MET . . . . . . . . . . . . . 40.0 mmm -51.23 -42.8 61.22 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 126.9 2.08 . . . . 0.0 115.003 179.545 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 205' ' ' LEU . . . . . . . . . . . . . 9.5 mp -57.76 -34.92 70.06 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.247 1.573 . . . . 0.0 115.247 175.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 206' ' ' LEU . . . . . 0.805 HD12 ' HG2' ' A' ' 39' ' ' GLN 0.281 13.4 mt -80.89 -19.54 44.17 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 121.128 -0.983 . . . . 0.0 109.624 -174.409 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' B' B ' 207' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -80.67 -49.96 10.55 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.151 0.981 . . . . 0.0 110.385 171.322 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -57.18 -43.1 82.34 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 128.013 2.525 . . . . 0.0 114.606 177.473 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 209' ' ' ALA . . . . . . . . . . . . . . . -60.14 -43.01 96.05 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.923 1.289 . . . . 0.0 112.837 175.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 210' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -72.89 -35.0 67.02 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 121.042 -1.036 . . . . 0.0 112.395 -179.87 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 211' ' ' TYR . . . . . . . . . . . . . 29.6 t80 -60.17 -49.7 76.59 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 126.334 1.854 . . . . 0.0 111.744 170.719 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . 12.8 mt -69.16 -24.47 64.08 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.473 -1.392 . . . . 0.0 114.699 -179.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 213' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -63.49 -46.9 84.02 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 119.918 -1.739 . . . . 0.0 113.242 167.031 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 214' ' ' ARG . . . . . . . . . . . . . 45.6 mtt180 -64.95 -39.51 93.61 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 174.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 215' ' ' ARG . . . . . . . . . . . . . 6.9 ttt-85 -69.2 -28.08 66.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.607 1.706 . . . . 0.0 115.607 179.75 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -69.64 -26.74 64.56 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 120.224 -1.548 . . . . 0.0 113.644 170.011 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 217' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.23 -26.4 68.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.249 -1.532 . . . . 0.0 113.067 175.463 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 218' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -67.76 -36.28 80.22 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.014 -1.679 . . . . 0.0 113.452 170.332 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 219' ' ' ALA . . . . . . . . . . . . . . . -68.88 -19.11 64.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.628 -1.295 . . . . 0.0 113.233 173.573 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 220' ' ' GLU . . . . . . . . . . . . . 95.5 mt-10 -74.5 -17.75 60.71 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 177.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 221' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 . . . . . 0 C--O 1.26 1.607 0 N-CA-C 115.996 1.85 . . . . 0.0 115.996 -177.375 . . . . . . . . 0 0 . 1 stop_ save_